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19694-10-1

Basic Information
CAS No.: 19694-10-1
Name: 3-Amino-4-chlorobenzamide
Article Data: 4
Molecular Structure:
Molecular Structure of 19694-10-1 (3-Amino-4-chlorobenzamide)
Formula: C7H7ClN2O
Molecular Weight: 170.598
Synonyms: 4-Chloro-3-aminobenzamide;3-Amino-4-chlorobenzamide;
EINECS: 243-231-4
Density: 1.394 g/cm3
Melting Point: 167-171 °C(lit.)
Boiling Point: 307.559 °C at 760 mmHg
Flash Point: 139.807 °C
Appearance: beige crystalline powder
Hazard Symbols: IrritantXi
Risk Codes: 36/37/38
Safety: 26-36-37/39
PSA: 69.11000
LogP: 2.30260
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  • 3-Amino-4-chlorobenzamide  CAS NO.19694-10-1

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Specification

The CAS register number of Benzamide,3-amino-4-chloro- is 19694-10-1. It also can be called as 3-Amino-4-chloro-benzamide and the IUPAC name about this chemical is 3-amino-4-chlorobenzamide. The molecular formula about this chemical is C7H7ClN2O and the molecular weight is 170.6. It belongs to the following product categories which include Intermediates of Dyes and Pigments; Aromatic Carboxylic Acids, Amides, Anilides, Anhydrides & Salts; Amides; Carbonyl Compounds; Organic Building Blocks and so on.

Physical properties about Benzamide,3-amino-4-chloro- are: (1)ACD/LogP: 1.48; (2)ACD/LogD (pH 5.5): 1.48; (3)ACD/LogD (pH 7.4): 1.48; (4)ACD/BCF (pH 5.5): 7.82; (5)ACD/BCF (pH 7.4): 7.82; (6)ACD/KOC (pH 5.5): 151.64; (7)ACD/KOC (pH 7.4): 151.65; (8)#H bond acceptors: 3; (9)#H bond donors: 4; (10)#Freely Rotating Bonds: 2; (11)Polar Surface Area: 23.55Å2; (12)Index of Refraction: 1.644; (13)Molar Refractivity: 44.31 cm3; (14)Molar Volume: 122.3 cm3; (15)Polarizability: 17.56x10-24cm3; (16)Surface Tension: 62 dyne/cm; (17)Flash Point: 139.8 °C; (18)Enthalpy of Vaporization: 54.82 kJ/mol; (19)Boiling Point: 307.6 °C at 760 mmHg; (20)Vapour Pressure: 0.000719 mmHg at 25°C.

When you are using this chemical, please be cautious about it as the following:
This chemical is irritating to eyes, respiratory system and skin. When you are using it, wear suitable protective clothing, gloves and eye/face protection. In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.

You can still convert the following datas into molecular structure:
(1)SMILES: Clc1ccc(C(=O)N)cc1N
(2)InChI: InChI=1/C7H7ClN2O/c8-5-2-1-4(7(10)11)3-6(5)9/h1-3H,9H2,(H2,10,11)
(3)InChIKey: QHMDKGRWJVOUFU-UHFFFAOYAZ
(4)Std. InChI: InChI=1S/C7H7ClN2O/c8-5-2-1-4(7(10)11)3-6(5)9/h1-3H,9H2,(H2,10,11)
(5)Std. InChIKey: QHMDKGRWJVOUFU-UHFFFAOYSA-N