3-Chloro-2-methyl-1-propene

Modify Date: 2026-07-02 12:31:24

3-Chloro-2-methyl-1-propene Structure
3-Chloro-2-methyl-1-propene structure
Common Name 3-Chloro-2-methyl-1-propene
CAS Number 563-47-3 Molecular Weight 90.551
Density 0.9±0.1 g/cm3 Boiling Point 72.4±9.0 °C at 760 mmHg
Molecular Formula C4H7Cl Melting Point -80 °C
MSDS Chinese USA Flash Point -10.0±0.0 °C
Symbol GHS02 GHS05 GHS07 GHS09
GHS02, GHS05, GHS07, GHS09
Signal Word Danger

 Names

This table lists Chinese names, IUPAC names and various aliases of this chemical substance.

Name 3-Chloro-2-methylpropene
Synonym More Synonyms

 Chemical & Physical Properties

This table shows physicochemical parameters including melting point, boiling point, density, solubility and optical rotation. Missing data is marked as N/A.

Density 0.9±0.1 g/cm3
Boiling Point 72.4±9.0 °C at 760 mmHg
Melting Point -80 °C
Molecular Formula C4H7Cl
Molecular Weight 90.551
Flash Point -10.0±0.0 °C
Exact Mass 90.023628
LogP 2.20
Vapour density 3.12 (vs air)
Vapour Pressure 129.6±0.1 mmHg at 25°C
Index of Refraction 1.410
InChIKey OHXAOPZTJOUYKM-UHFFFAOYSA-N
SMILES C=C(C)CCl
Water Solubility 0.5 g/L (20 ºC)

 MSDS

This table provides MSDS information including hazard classification, first‑aid, fire‑fighting, spill handling, operation and storage instructions.

 Toxicological Information

This table summarizes toxicological test data, acute & chronic toxicity and ecological hazard parameters for this chemical.

CHEMICAL IDENTIFICATION

RTECS NUMBER :
UC8050000
CHEMICAL NAME :
Propene, 3-chloro-2-methyl-
CAS REGISTRY NUMBER :
563-47-3
BEILSTEIN REFERENCE NO. :
0878160
LAST UPDATED :
199801
DATA ITEMS CITED :
30
MOLECULAR FORMULA :
C4-H7-Cl
MOLECULAR WEIGHT :
90.56
WISWESSER LINE NOTATION :
G1Y1&U1

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LCLo - Lowest published lethal concentration
ROUTE OF EXPOSURE :
Inhalation
SPECIES OBSERVED :
Human
DOSE/DURATION :
22000 ppm/10M
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
848 mg/kg
TOXIC EFFECTS :
Behavioral - tremor Gastrointestinal - hypermotility, diarrhea Blood - hemorrhage
TYPE OF TEST :
LC50 - Lethal concentration, 50 percent kill
ROUTE OF EXPOSURE :
Inhalation
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
34 gm/m3/30M
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
TYPE OF TEST :
LDLo - Lowest published lethal dose
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
3160 mg/kg
TOXIC EFFECTS :
Gastrointestinal - other changes Liver - other changes Blood - changes in spleen
TYPE OF TEST :
TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
7 gm/kg/14D-I
TOXIC EFFECTS :
Related to Chronic Data - death
TYPE OF TEST :
TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
19500 mg/kg/13W-I
TOXIC EFFECTS :
Related to Chronic Data - death
TYPE OF TEST :
TCLo - Lowest published toxic concentration
ROUTE OF EXPOSURE :
Inhalation
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
16 gm/m3/1H/5W-I
TOXIC EFFECTS :
Related to Chronic Data - death
TYPE OF TEST :
TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
10500 mg/kg/14D-I
TOXIC EFFECTS :
Related to Chronic Data - death
TYPE OF TEST :
TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
81250 mg/kg/13W-I
TOXIC EFFECTS :
Liver - other changes Kidney, Ureter, Bladder - changes in tubules (including acute renal failure, acute tubular necrosis) Related to Chronic Data - death
TYPE OF TEST :
TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
77250 mg/kg/2Y-I
TOXIC EFFECTS :
Tumorigenic - Carcinogenic by RTECS criteria Endocrine - adrenal cortex tumors
TYPE OF TEST :
TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
38625 mg/kg/2Y-I
TOXIC EFFECTS :
Tumorigenic - equivocal tumorigenic agent by RTECS criteria Gastrointestinal - tumors
TYPE OF TEST :
TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
51500 mg/kg/2Y-I
TOXIC EFFECTS :
Tumorigenic - Carcinogenic by RTECS criteria Gastrointestinal - tumors
TYPE OF TEST :
TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
51500 mg/kg/2Y-I
TOXIC EFFECTS :
Tumorigenic - equivocal tumorigenic agent by RTECS criteria Gastrointestinal - tumors
TYPE OF TEST :
TD - Toxic dose (other than lowest)
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
77250 mg/kg/2Y-I
TOXIC EFFECTS :
Tumorigenic - neoplastic by RTECS criteria Gastrointestinal - tumors Reproductive - Tumorigenic effects - testicular tumors
TYPE OF TEST :
Sex chromosome loss and nondisjunction

MUTATION DATA

TYPE OF TEST :
Sister chromatid exchange
TEST SYSTEM :
Rodent - hamster Ovary
DOSE/DURATION :
16 mg/L
REFERENCE :
EMMUEG Environmental and Molecular Mutagenesis. (Alan R. Liss, Inc., 41 E. 11th St., New York, NY 10003) V.10- 1987- Volume(issue)/page/year: 13,133,1989 *** REVIEWS *** IARC Cancer Review:Animal Limited Evidence IMEMDT IARC Monographs on the Evaluation of Carcinogenic Risk of Chemicals to Man. (WHO Publications Centre USA, 49 Sheridan Ave., Albany, NY 12210) V.1- 1972- Volume(issue)/page/year: 63,325,1995 IARC Cancer Review:Human Inadequate Evidence IMEMDT IARC Monographs on the Evaluation of Carcinogenic Risk of Chemicals to Man. (WHO Publications Centre USA, 49 Sheridan Ave., Albany, NY 12210) V.1- 1972- Volume(issue)/page/year: 63,325,1995 IARC Cancer Review:Group 3 IMEMDT IARC Monographs on the Evaluation of Carcinogenic Risk of Chemicals to Man. (WHO Publications Centre USA, 49 Sheridan Ave., Albany, NY 12210) V.1- 1972- Volume(issue)/page/year: 63,325,1995 *** OCCUPATIONAL EXPOSURE LIMITS *** OEL-RUSSIA:STEL 0.3 mg/m3;Skin JAN 1993 *** NIOSH STANDARDS DEVELOPMENT AND SURVEILLANCE DATA *** NIOSH OCCUPATIONAL EXPOSURE SURVEY DATA : NOHS - National Occupational Hazard Survey (1974) NOHS Hazard Code - 83971 No. of Facilities: 33 (estimated) No. of Industries: 1 No. of Occupations: 2 No. of Employees: 1683 (estimated)

 Safety Information

This table covers safety warnings, protective measures, incompatible substances and disposal guidelines for this compound.

Symbol GHS02 GHS05 GHS07 GHS09
GHS02, GHS05, GHS07, GHS09
Signal Word Danger
Hazard Statements H225-H302 + H332-H314-H317-H411
Precautionary Statements P210-P273-P280-P305 + P351 + P338-P310
Personal Protective Equipment Faceshields;full-face respirator (US);Gloves;Goggles;multi-purpose combination respirator cartridge (US);type ABEK (EN14387) respirator filter
Hazard Codes F:Flammable;C:Corrosive;N:Dangerousfortheenvironment;
Risk Phrases R11;R20/22;R34;R43;R51/53
Safety Phrases S9-S16-S29-S36/37/39-S45-S61-S26
RIDADR UN 2554 3/PG 2
WGK Germany 2
RTECS UC8050000
Packaging Group II
Hazard Class 3
HS Code 2903299090

 Synthetic Route

This table presents publicly reported synthetic routes, reaction conditions, reactants and product information of the compound.

 Customs

This table shows customs‑related data including HS‑code, tariff and regulatory conditions for import and export.

HS Code 2903299090
Summary 2903299090 other unsaturated chlorinated derivatives of acyclic hydrocarbons。Supervision conditions:None。VAT:17.0%。Tax rebate rate:9.0%。MFN tariff:5.5%。General tariff:30.0%

 Articles16

More Articles

This table lists relevant public references with title, journal and publication metadata for this compound.

NTP Toxicology and Carcinogenesis Studies of 3-Chloro-2-methylpropene (Technical grade containing 5% dimethylvinyl chloride) (CAS No. 563-47-3) in F344/N Rats and B6C3F1 Mice (Gavage Studies).

Natl. Toxicol. Program Tech. Rep. Ser. 300 , 1-196, (1986)

Toxicology and carcinogenesis studies of technical-grade 3-chloro-2-methylpropene (containing 5% dimethylvinyl chloride), a widely used insecticide and a chemical intermediate, were performed on F344/...

3-Chloro-2-methylpropene.

IARC Monogr. Eval. Carcinog. Risks Hum. 63 , 325-33, (1995)

3-Chloro-2-methylpropene.

Rep. Carcinog. 12 , 100-1, (2011)

 3-Chloro-2-methyl-1-propeneBioassay

View more

This table contains target information, in‑vitro & in‑vivo assay data for this compound.

Name: p53 small molecule agonists, cell-based qHTS assay
Source: 824
External Id: P53344
Name: p53 small molecule agonists, cell-based qHTS assay with human liver microsomes
Source: 824
Target: tumor suppressor p53 [Homo sapiens]
External Id: P53MS233
Name: p53 small molecule agonists, cell-based qHTS assay with rat liver microsomes
Source: 824
Target: tumor suppressor p53 [Homo sapiens]
External Id: P53MS898
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 Synonyms

This table collects all English aliases, systematic names and CAS‑related synonyms of the compound.

MFCD00000953
EINECS 209-251-2
3-Chloro-2-methyl-1-propene
3-Chloro-2-methylprop-1-ene

 3-Chloro-2-methyl-1-propene | FAQ

This section contains frequently‑asked‑questions about this compound, including basic parameters, properties, storage conditions and corresponding answers.

Q: What is the boiling point of 3-Chloro-2-methylpropene?
A: Boiling point of 3-Chloro-2-methylpropene is 72.4±9.0 °C at 760 mmHg.
Q: What is the molecular weight of 3-Chloro-2-methylpropene?
A: Molecular weight of 3-Chloro-2-methylpropene is 90.551.
Q: What are the downstream products of 3-Chloro-2-methylpropene?
A: Related downstream products(CAS) of 3-Chloro-2-methylpropene: 10500-86-4;10523-77-0;111719-00-7;10474-14-3;109930-20-3;40463-03-4;3290-53-7;300-57-2;42288-08-4;4911-54-0.
Q: What English synonyms does 3-Chloro-2-methylpropene have?
A: English synonyms of 3-Chloro-2-methylpropene: MFCD00000953, EINECS 209-251-2, 3-Chloro-2-methyl-1-propene, 3-Chloro-2-methylprop-1-ene.
Q: How is the water solubility of 3-Chloro-2-methylpropene?
A: Water solubility of 3-Chloro-2-methylpropene: 0.5 g/L (20 ºC).
Q: What is the safety information for 3-Chloro-2-methylpropene?
A: Safety information for 3-Chloro-2-methylpropene: S9-S16-S29-S36/37/39-S45-S61-S26.
Q: What is the SMILES notation of 3-Chloro-2-methylpropene?
A: SMILES notation of 3-Chloro-2-methylpropene is C=C(C)CCl.
Q: What are the upstream materials of 3-Chloro-2-methylpropene?
A: Related upstream materials(CAS) of 3-Chloro-2-methylpropene: 32670-93-2;115-11-7;628-56-8;78538-54-2;64-19-7;3100-04-7;7782-50-5;594-37-6.
Q: What is the InChIKey of 3-Chloro-2-methylpropene?
A: InChIKey of 3-Chloro-2-methylpropene is OHXAOPZTJOUYKM-UHFFFAOYSA-N.
Q: What is the LogP of 3-Chloro-2-methylpropene?
A: LogP of 3-Chloro-2-methylpropene is 2.20.

 3-Chloro-2-methyl-1-propenefactory

This table lists manufacturers and suppliers of this compound, including vendor names and product supply reference information.

Shanghai Nianxing Industrial Co., Ltd
Dayang Chem (Hangzhou) Co., Ltd.
Henan Tianfu Chemical Co., Ltd.
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