3'-Nitroacetophenone

Modify Date: 2024-01-02 07:26:00

3'-Nitroacetophenone Structure
3'-Nitroacetophenone structure
 Common Name 3'-Nitroacetophenone
CAS Number 121-89-1 Molecular Weight 165.146
Density 1.2±0.1 g/cm3 Boiling Point 237.3±13.0 °C at 760 mmHg
Molecular Formula C8H7NO3 Melting Point 76-78 °C(lit.)
MSDS Chinese USA Flash Point 99.9±12.6 °C

 Names

Name 3-Nitroacetophenone
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.2±0.1 g/cm3
Boiling Point 237.3±13.0 °C at 760 mmHg
Melting Point 76-78 °C(lit.)
Molecular Formula C8H7NO3
Molecular Weight 165.146
Flash Point 99.9±12.6 °C
Exact Mass 165.042587
PSA 62.89000
LogP 1.49
Vapour Pressure 0.0±0.5 mmHg at 25°C
Index of Refraction 1.558
Stability Stable. Incompatible with strong oxidizing agents, strong bases.
Water Solubility <0.01 g/100 mL at 20 ºC

 Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
AM9625000
CHEMICAL NAME :
Acetophenone, 3'-nitro-
CAS REGISTRY NUMBER :
121-89-1
LAST UPDATED :
199806
DATA ITEMS CITED :
6
MOLECULAR FORMULA :
C8-H7-N-O3
MOLECULAR WEIGHT :
165.16
WISWESSER LINE NOTATION :
WNR CV1

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
Standard Draize test
ROUTE OF EXPOSURE :
Administration onto the skin
SPECIES OBSERVED :
Rodent - rabbit
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
3250 mg/kg
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 :
Intraperitoneal
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
200 mg/kg
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 :
Administration onto the skin
SPECIES OBSERVED :
Rodent - rabbit
DOSE/DURATION :
3 mL/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value

MUTATION DATA

TYPE OF TEST :
Mutation in microorganisms
TEST SYSTEM :
Bacteria - Salmonella typhimurium
DOSE/DURATION :
1 mg/plate
REFERENCE :
ENMUDM Environmental Mutagenesis. (New York, NY) V.1-9, 1979-87. For publisher information, see EMMUEG. Volume(issue)/page/year: 9(Suppl 9),1,1987

 Safety Information

Personal Protective Equipment Eyeshields;Gloves;type N95 (US);type P1 (EN143) respirator filter
Hazard Codes Xn:Harmful
Risk Phrases R21
Safety Phrases 22-24/25
RIDADR UN 2735 8/PG 3
WGK Germany 2
RTECS AM9625000
Packaging Group III
Hazard Class 8
HS Code 29147090

 Synthetic Route

 Customs

HS Code 2914700090
Summary HS: 2914700090 halogenated, sulphonated, nitrated or nitrosated derivatives of ketones and quinones, whether or not with other oxygen function Tax rebate rate:9.0% Supervision conditions:none VAT:17.0% MFN tariff:5.5% General tariff:30.0%

 Synonyms

3’-Nitroacetophenone
MFCD00007259
Ethanone, 1-(3-nitrophenyl)-
1-(3-Nitrophenyl)ethanone
3'-Nitroacetophenone
m-Nitroacetophenone
3-Nitroacetophenone
EINECS 204-504-3
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