CAS No.157069-52-8,4-AMINO-3-CHLORO-5-METHYLBENZOIC ACID Suppliers

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Basic Information

Molecular Structure:
CAS No.:	157069-52-8
Name:	4-AMINO-3-CHLORO-5-METHYLBENZOIC ACID

Formula:	C₈H₈ClNO₂
Molecular Weight:	185.61
Synonyms:	4-Amino-3-chloro-5-methylbenzoicacid;
Density:	1.401 g/cm³
Melting Point:	274 °C
Boiling Point:	348.1 °C at 760 mmHg
Flash Point:	164.3 °C
Hazard Symbols:	Xi
Risk Codes:	36/37/38
Safety:	26-36/37/39
PSA:	63.32000
LogP:	2.51000

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- China (Mainland)(13)
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Specification

The Benzoic acid,4-amino-3-chloro-5-methyl-, with the CAS registry number 157069-52-8, is also known as 4-Amino-3-chloro-5-methylbenzoic acid 95%. This chemical's molecular formula is C₈H₈ClNO₂ and molecular weight is 185.61. Its systematic name is called 4-amino-3-chloro-5-methylbenzoic acid.

Physical properties of Benzoic acid,4-amino-3-chloro-5-methyl-: (1)ACD/LogP: 2.68; (2)ACD/LogD (pH 5.5): 1.7; (3)ACD/LogD (pH 7.4): 0.02; (4)ACD/BCF (pH 5.5): 6.75; (5)ACD/BCF (pH 7.4): 1; (6)ACD/KOC (pH 5.5): 72.13; (7)ACD/KOC (pH 7.4): 1.49; (8)#H bond acceptors: 3; (9)#H bond donors: 3; (10)#Freely Rotating Bonds: 2; (11)Index of Refraction: 1.63; (12)Molar Refractivity: 47.13 cm³; (13)Molar Volume: 132.4 cm³; (14)Surface Tension: 60 dyne/cm; (15)Density: 1.401 g/cm³; (16)Flash Point: 164.3 °C; (17)Enthalpy of Vaporization: 62.52 kJ/mol; (18)Boiling Point: 348.1 °C at 760 mmHg; (19)Vapour Pressure: 1.94E-05 mmHg at 25°C.

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

You can still convert the following datas into molecular structure:
(1)SMILES: Clc1cc(cc(c1N)C)C(=O)O
(2)InChI: InChI=1/C8H8ClNO2/c1-4-2-5(8(11)12)3-6(9)7(4)10/h2-3H,10H2,1H3,(H,11,12)
(3)InChIKey: QDVXQZIEVDLRRT-UHFFFAOYAV