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Basic Information
CAS No.: 22987-10-6
Name: Propanamide,N-(3-aminophenyl)-
Article Data: 10
Molecular Structure:
Molecular Structure of 22987-10-6 (Propanamide,N-(3-aminophenyl)-)
Formula: C9H12N2O
Molecular Weight: 164.207
Synonyms: 3'-Aminopropionanilide;N-(3-Aminophenyl)propionamide;m-Aminopropionanilide;
EINECS: 245-369-0
Density: 1.162 g/cm3
Melting Point: 92-96 °C(lit.)
Boiling Point: 392.028 °C at 760 mmHg
Flash Point: 190.892 °C
Hazard Symbols: IrritantXi
Risk Codes: 36/37/38
Safety: 26-36
PSA: 55.12000
LogP: 2.27150
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    N-(3-Aminophenyl)propionamide CAS No.:22987-10-6 Name: N-(3-Aminophenyl)propionamide Molecular Structure Molecular Formula: C9H12N2O Molecular Weight: 164.21 CAS Registry Number: 22987-10-6 EINECS: 245-3

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Chemistry

Molecular structure of Propanamide,N-(3-aminophenyl)- (CAS NO.22987-10-6):

IUPAC Name: N-(3-Aminophenyl)propanamide
Molecular Weight: 164.20438 [g/mol]
Molecular Formula: C9H12N2O
XLogP3: 0.9
H-Bond Donor: 2
H-Bond Acceptor: 2
Rotatable Bond Count: 2
Tautomer Count: 2
Exact Mass: 164.094963
MonoIsotopic Mass: 164.094963
Topological Polar Surface Area: 55.1
Heavy Atom Count: 12
Complexity: 159
Index of Refraction: 1.616
Molar Refractivity: 49.39 cm3
Molar Volume: 141.3 cm3
Surface Tension: 50.4 dyne/cm
Density: 1.162 g/cm3 
Melting Point: 92-96 °C(lit.)
Flash Point: 190.9 °C
Enthalpy of Vaporization: 64.17 kJ/mol
Boiling Point: 392 °C at 760 mmHg
Vapour Pressure: 2.36E-06 mmHg at 25 °C
Canonical SMILES: CCC(=O)NC1=CC=CC(=C1)N
InChI: InChI=1S/C9H12N2O/c1-2-9(12)11-8-5-3-4-7(10)6-8/h3-6H,2,10H2,1H3,(H,11,12)
InChIKey: VGDKCRMZIWPMPW-UHFFFAOYSA-N
EINECS: 245-369-0
Product Categories: Intermediates of Dyes and Pigments; Aromatic Carboxylic Acids, Amides, Anilides, Anhydrides & Salts; Amides; Carbonyl Compounds; Organic Building Blocks

Uses

 Propanamide,N-(3-aminophenyl)- (CAS NO.22987-10-6) is used as dye intermediates.

Safety Profile

Hazard Codes: IrritantXi
Risk Statements: 36/37/38
R36/37/38:Irritating to eyes, respiratory system and skin.
Safety Statements: 26-36
S26: In case of contact with eyes, rinse immediately with plenty of water and seek medical advice. 
S36:Wear suitable protective clothing.
WGK Germany: 3

Specification

 Propanamide,N-(3-aminophenyl)- (CAS NO.22987-10-6) is also called 3-Amino propionylanilide ; N-(3-Aminophenyl)propionamide ; m-Amino propionanilide ; N-(3-Aminophenyl)-propionamide .