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  • Acetamide,N-(3-aminophenyl)
Name:Acetamide,N-(3-aminophenyl)
CAS No:102-28-3

PRODUCT DESCRIPTION

【Name】
Acetamide,N-(3-aminophenyl)-
【Iupac name】
N-(3-aminophenyl)acetamide
【CAS Registry number】
102-28-3
【Synonyms】
m-Aminoacetanilide
Acetanilide,3'-amino- (6CI,7CI,8CI)
1-Acetylamino-3-aminobenzene
1-Amino-3-(acetylamino)benzene
3-(Acetylamino)aniline
3-Acetamidoaniline
3-Acetylaminobenzeneamine
3-Amino-N-acetylaniline
N-(3-Aminophenyl)acetamide
N-Acetyl-1,3-diaminobenzene
N-Acetyl-m-phenylenediamine
NSC 165576
m-(Acetylamino)aniline
m-Acetamidoaniline
【EINECS(EC#)】
203-021-5
【Molecular Formula】
C8H10N2O (Products with the same molecular formula)
【Molecular Weight】
150.18
【Inchi】
InChI=1/C8H10N2O/c1-6(11)10-8-4-2-3-7(9)5-8/h2-5H,9H2,1H3,(H,10,11)
【Canonical SMILES】
CC(=O)NC1=CC=CC(=C1)N
【MOL File】
102-28-3.mol

Chemical and Physical Properties

【Appearance】
Gray solid.
【Density】
1.203g/cm3
【Melting Point】
84-88℃
【Boiling Point】
388.9°Cat760mmHg
【Vapour】
2.96E-06mmHg at 25°C
【Refractive Index】
1.636
【Flash Point】
189°C
【Water】
1-5 g/100 mL at 24℃
【Solubilities】
1-5 g/100 mL at 24 oC
【Stability】
No data.
【Storage temp】
Store in a cool, dry place. Store in a tightly closed container.
【Computed Properties】
Molecular Weight:150.1778 [g/mol]
Molecular Formula:C8H10N2O
XLogP3:0.9
H-Bond Donor:2
H-Bond Acceptor:2
Rotatable Bond Count:1
Tautomer Count:3
Exact Mass:150.079313
MonoIsotopic Mass:150.079313
Topological Polar Surface Area:55.1
Heavy Atom Count:11
Formal Charge:0
Complexity:147
Isotope Atom Count:0
Defined Atom Stereocenter Count:0
Undefined Atom Stereocenter Count:0
Defined Bond Stereocenter Count:0
Undefined Bond Stereocenter Count:0
Covalently-Bonded Unit Count:1
Feature 3D Acceptor Count:1
Feature 3D Donor Count:2
Feature 3D Cation Count:1
Feature 3D Ring Count:1
Effective Rotor Count:2
Conformer Sampling RMSD:0.4
CID Conformer Count:4

Safety and Handling

【Hazard Codes】
Xi:Irritant;
【Risk Statements】
R36/37/38
【Safety Statements 】
S26;S37/39
【HazardClass】
IRRITANT
【Safety】
Hazard Codes:Xi
Risk Statements:36/37/38
36/37/38:Irritating to eyes, respiratory system and skin
Safety Statements:26-36-37/39
26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice
36:Wear suitable protective clothing
37/39:Wear suitable protective clothing, gloves and eye/face protection
WGK Germany:3
HazardClass:IRRITANT
【PackingGroup 】
III
【Specification】

light brown crystalline powder
Safety Statements:26-36-37/39
26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice
36:Wear suitable protective clothing
37/39:Wear suitable protective clothing, gloves and eye/face protection

Biomedical Effects and Toxicity

【Pharmacological Action】
ACUTE/CHRONIC HAZARDS: When heated to decomposition N1-(3-Aminophenyl)acetamide emits toxic fumes.

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