1-Bromo-2-methylpropane

Modify Date: 2025-08-21 09:52:07

1-Bromo-2-methylpropane Structure
1-Bromo-2-methylpropane structure
Common Name 1-Bromo-2-methylpropane
CAS Number 78-77-3 Molecular Weight 137.018
Density 1.3±0.1 g/cm3 Boiling Point 90.7±8.0 °C at 760 mmHg
Molecular Formula C4H9Br Melting Point -119 °C
MSDS Chinese USA Flash Point 18.3±0.0 °C
Symbol GHS02 GHS07
GHS02, GHS07
Signal Word Danger

 Names

Name 1-Bromo-2-Methylpropane
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.3±0.1 g/cm3
Boiling Point 90.7±8.0 °C at 760 mmHg
Melting Point -119 °C
Molecular Formula C4H9Br
Molecular Weight 137.018
Flash Point 18.3±0.0 °C
Exact Mass 135.988754
LogP 2.56
Vapour Pressure 62.9±0.2 mmHg at 25°C
Index of Refraction 1.436
InChIKey HLVFKOKELQSXIQ-UHFFFAOYSA-N
SMILES CC(C)CBr
Water Solubility 0.51 g/L (18 ºC)

 Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
TX4140000
CHEMICAL NAME :
Propane, 1-bromo-2-methyl-
CAS REGISTRY NUMBER :
78-77-3
LAST UPDATED :
199709
DATA ITEMS CITED :
5
MOLECULAR FORMULA :
C4-H9-Br
MOLECULAR WEIGHT :
137.04
WISWESSER LINE NOTATION :
E1Y1&1

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
1660 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
GTPZAB Gigiena Truda i Professional'nye Zabolevaniya. Labor Hygiene and Occupational Diseases. (V/O Mezhdunarodnaya Kniga, 113095 Moscow, USSR) V.1-36, 1957-1992. For publisher information, see MTPEEI Volume(issue)/page/year: 20(12),52,1976
TYPE OF TEST :
LC50 - Lethal concentration, 50 percent kill
ROUTE OF EXPOSURE :
Inhalation
SPECIES OBSERVED :
Mammal - species unspecified
DOSE/DURATION :
50500 mg/m3
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
GTPZAB Gigiena Truda i Professional'nye Zabolevaniya. Labor Hygiene and Occupational Diseases. (V/O Mezhdunarodnaya Kniga, 113095 Moscow, USSR) V.1-36, 1957-1992. For publisher information, see MTPEEI Volume(issue)/page/year: 18(4),55,1974 ** TUMORIGENIC DATA **
TYPE OF TEST :
TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
3000 mg/kg/8W-I
TOXIC EFFECTS :
Tumorigenic - neoplastic by RTECS criteria Lungs, Thorax, or Respiration - tumors
REFERENCE :
CNREA8 Cancer Research. (Public Ledger Building, Suit 816, 6th & Chestnut Sts., Philadelphia, PA 19106) V.1- 1941- Volume(issue)/page/year: 35,1411,1975

 Safety Information

Symbol GHS02 GHS07
GHS02, GHS07
Signal Word Danger
Hazard Statements H225-H315-H319-H335
Precautionary Statements P210-P261-P305 + P351 + P338
Personal Protective Equipment Eyeshields;Faceshields;full-face respirator (US);Gloves;multi-purpose combination respirator cartridge (US);type ABEK (EN14387) respirator filter
Hazard Codes F:Flammable
Risk Phrases R11;R36/37/38
Safety Phrases S16-S23-S37/39-S26
RIDADR UN 2342 3/PG 2
WGK Germany 3
RTECS TX4140000
Packaging Group II
Hazard Class 3
HS Code 2903299090

 Synthetic Route

 Customs

HS Code 2903399090
Summary 2903399090. brominated,fluorinated or iodinated derivatives of acyclic hydrocarbons. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:5.5%. General tariff:30.0%

 Articles1

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 1-Bromo-2-methylpropaneBioassay

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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
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Target: tumor suppressor p53 [Homo sapiens]
External Id: P53MS233
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Target: tumor suppressor p53 [Homo sapiens]
External Id: P53MS898
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 Synonyms

1-Bromo-2-methylpropane
EINECS 201-141-2
1-Bromo-2-methyl propane
MFCD00000217
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