3'-Nitroacetophenone
Names
[ CAS No. ]:
121-89-1
[ Name ]:
3'-Nitroacetophenone
[Synonym ]:
3’-Nitroacetophenone
MFCD00007259
Ethanone, 1-(3-nitrophenyl)-
1-(3-Nitrophenyl)ethanone
3'-Nitroacetophenone
m-Nitroacetophenone
3-Nitroacetophenone
EINECS 204-504-3
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
MSDS
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
Precursor & DownStream
Precursor
DownStream
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%