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1688-71-7

Basic Information
CAS No.: 1688-71-7
Name: 4'-AMINOBUTYROPHENONE
Article Data: 7
Molecular Structure:
Molecular Structure of 1688-71-7 (4'-AMINOBUTYROPHENONE)
Formula: C10H13 N O
Molecular Weight: 163.219
Synonyms: Butyrophenone,4'-amino- (6CI,7CI,8CI); 1-(4-Aminophenyl)butan-1-one; 4'-Aminobutyrophenone;p-Aminobutyrophenone
Density: 1.044g/cm3
Melting Point: 94 °C
Boiling Point: 318°Cat760mmHg
Flash Point: 146.1°C
Hazard Symbols:
Risk Codes: 36/37/38
Safety: Poison by ingestion and intraperitoneal routes. When heated to decomposition it emits toxic vapors of NOx.
PSA: 43.09000
LogP: 2.83280
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Chemistry

IUPAC Name: 1-(4-Aminophenyl)butan-1-one
Synonyms: Butyrophenone, p-amino- ; 1-(4-Aminophenyl)-1-butanone ; 1-Butanone, 1-(4-aminophenyl)- ; 4-14-00-00166 (Beilstein Handbook Reference) [Beilstein] ; 4'-Aminobutyrophenone
Product Categories: Aromatic Ketones (substituted);API intermediates
CAS NO: 1688-71-7
Molecular Formula of 4'-Aminobutyrophenone (CAS NO.1688-71-7) : C10H13NO
Molecular Weight of 4'-Aminobutyrophenone (CAS NO.1688-71-7) :163.22
Molecular Structure of 4'-Aminobutyrophenone (CAS NO.1688-71-7) :
Mol File: 1688-71-7.mol
Index of Refraction: 1.55
Surface Tension: 42 dyne/cm
Density: 1.044 g/cm3
Flash Point: 146.1 °C
Enthalpy of Vaporization: 55.94 kJ/mol
Boiling Point: 318 °C at 760 mmHg
Vapour Pressure: 0.000372 mmHg at 25°C
Melting point: 94 °C

Toxicity Data With Reference

1.    

orl-rat LD50:84 mg/kg

    GEPHDP    General Pharmacology. 14 (1983),465.
2.    

orl-mus LD50:133 mg/kg

    GEPHDP    General Pharmacology. 14 (1983),465.
3.    

ipr-mus LD50:183 mg/kg

    GEPHDP    General Pharmacology. 14 (1983),465.
4.    

orl-qal LD50:178 mg/kg

    AECTCV    Archives of Environmental Contamination and Toxicology. 12 (1983),355.
5.    

orl-brd LD50:42,200 µg/kg

    AECTCV    Archives of Environmental Contamination and Toxicology. 12 (1983),355.

Consensus Reports

Reported in EPA TSCA Inventory.

Safety Profile

Poison by ingestion and intraperitoneal routes. When heated to decomposition it emits toxic vapors of NOx.
Hazard Codes IrritantXi
Risk Statements 36/37/38
R36/37/38:Irritating to eyes, respiratory system and skin.
Safety Statements 26-36/37/39
S26: In case of contact with eyes, rinse immediately with plenty of water and seek medical advice. 
S36/37/39:Wear suitable protective clothing, gloves and eye/face protection.
Hazard Note Irritant

Specification

Category: toxic substances
Toxicity classification: highly toxic
Acute toxicity: Oral - rat LD50: 84 mg / kg; Oral - Mouse LD50: 133 mg / kg
Flammable hazardous characteristics: flammable; burning of toxic nitrogen oxide fumes
Storage features: Treasury ventilated low-temperature drying
Fire-extinguishing agent: dry powder, foam, sand, carbon dioxide, water mist