CAS No.13194-71-3,2-BROMO-4-METHYLANILINE HYDROCHLORIDE Suppliers,MSDS download

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Basic Information

Molecular Structure:
CAS No.:	13194-71-3
Name:	2-BROMO-4-METHYLANILINE HYDROCHLORIDE
Article Data:	1

Formula:	C₇H₉BrClN
Molecular Weight:	222.512
Synonyms:	Benzenamine,2-bromo-4-methyl-, hydrochloride (9CI);p-Toluidine, 2-bromo-, hydrochloride(7CI,8CI);2-Bromo-4-methylaniline hydrochloride;
EINECS:	209-515-7
Density:	1.498g/cm³
Boiling Point:	280.9 °C at 760 mmHg
Flash Point:	123.7 °C
Risk Codes:	36/37/38
Safety:	26-36
PSA:	26.02000
LogP:	3.72290

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Specification

The Benzenamine,2-bromo-4-methyl-, hydrochloride (1:1), with CAS registry number 13194-71-3, has the systematic name of 2-bromo-4-methylaniline hydrochloride. This chemical belongs to the following product categories: (1)Aromatic Hydrocarbons (substituted) & Derivatives; (2)Anilines, Amides & Amines; (3)Bromine Compounds. And the chemical formula of this chemical is C₇H₉BrClN.

Physical properties of Benzenamine,2-bromo-4-methyl-, hydrochloride (1:1): (1)ACD/LogP: 2.65; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 1; (4)#H bond donors: 2; (5)#Freely Rotating Bonds: 1; (6)Polar Surface Area: 26.02 Å²; (7)Flash Point: 123.7 °C; (8)Enthalpy of Vaporization: 53.01 kJ/mol; (9)Boiling Point: 280.9 °C at 760 mmHg; (10)Vapour Pressure: 0.00283 mmHg at 25°C.

When you are using this chemical, please be cautious about it as the following:
The Benzenamine,2-bromo-4-methyl-, hydrochloride (1:1) irritates to eyes, respiratory system and skin. When use it, wear suitable protective clothing, gloves and eye/face protection. If 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: Cl.Cc1cc(Br)c(N)cc1
(2)InChI: InChI=1/C7H8BrN.ClH/c1-5-2-3-7(9)6(8)4-5;/h2-4H,9H2,1H3;1H
(3)InChIKey: RDAPUTBVICJDLN-UHFFFAOYAD
(4)Std. InChI: InChI=1S/C7H8BrN.ClH/c1-5-2-3-7(9)6(8)4-5;/h2-4H,9H2,1H3;1H
(5)Std. InChIKey: RDAPUTBVICJDLN-UHFFFAOYSA-N