AG001PHF

1575-36-6 | 1,2-Benzenediamine, 3-bromo-

AG001PHF

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CAS Number	1575-36-6
Catalog Number	AG001PHF(AGN-PC-0NJ5F2)
Chemical Name	1,2-Benzenediamine, 3-bromo-
IUPAC Name	3-bromobenzene-1,2-diamine
InChI	InChI=1S/C6H7BrN2/c7-4-2-1-3-5(8)6(4)9/h1-3H,8-9H2
InChI Key	VWYTZNPMXYCBPK-UHFFFAOYSA-N
MDL Number	MFCD09842434
Molecular Formula	C6H7BrN2
Molecular Weight	187.0372
SMILES	Nc1c(Br)cccc1N
Synonyms	3-Bromobenzene-1,2-diamine, 1575-36-6, 3-BROMO-1,2-DIAMINOBENZENE, 1,2-Benzenediamine, 3-bromo-, 3-Bromo-1,2-benzenediamine, MFCD09842434, 3-bromophenylenediamine, 2,3-Diaminobromobenzene, 3-Brom-o-phenylendiamin, ACMC-209dg5, 1,2-diamino-3-bromobenzene, 1-Bromo-2,3-diaminobenzene, 3-Bromobenzene 1,2-diamine, 3-bromo-benzene-1,2-diamine, 3-Bromophenylene-1,2-diamine, SCHEMBL1013212, CTK3J4733, KS-00000ICW, DTXSID10500187, VWYTZNPMXYCBPK-UHFFFAOYSA-N, ANW-21699, EBD213053, ZINC15021415, AKOS015888595, CS-W019000, PS-3496, QC-3846, RTX-010506, 3-Bromo-1,2-diaminobenzene, AldrichCPR, AJ-66983, AK-47010, BR-47010, CJ-15009, SC-51913, AB0022536, 4CH-009200, FT-0686997, ST24028463, W3419, B-3777, I01-11160, C6H7BrN2, 3-Bromobenzene-1,2-diamine, 95% - 1G 1g, N/A,

Complexity	97.1
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	185.979g/mol
Formal Charge	0
Heavy Atom Count	9
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	187.04g/mol
Monoisotopic Mass	185.979g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	52A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.3

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	6.1
Hazard statements	H302-H315-H319-H335
Packing Group	Ⅲ
Precautionary statements	P261-P305+P351+P338
UN Code	UN 2811

Certificate of Analysis

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