AG0006SN

102169-44-8 | 1,2-Benzenediamine, 4-bromo-5-methyl-

AG0006SN

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CAS Number	102169-44-8
Catalog Number	AG0006SN(AGN-PC-03RWNZ)
Chemical Name	1,2-Benzenediamine, 4-bromo-5-methyl-
IUPAC Name	4-bromo-5-methylbenzene-1,2-diamine
InChI	InChI=1S/C7H9BrN2/c1-4-2-6(9)7(10)3-5(4)8/h2-3H,9-10H2,1H3
InChI Key	BYYYESJDKPVYGB-UHFFFAOYSA-N
MDL Number	MFCD16987757
Molecular Formula	C7H9BrN2
Molecular Weight	201.0638
SMILES	NC1=CC(C)=C(Br)C=C1N
Synonyms	4-bromo-5-methylbenzene-1,2-diamine, 102169-44-8, 4-bromo-5-methyl-1,2-benzenediamine, 1,2-Benzenediamine, 4-bromo-5-methyl-, SCHEMBL3046974, KS-00000QZS, DTXSID10625985, BYYYESJDKPVYGB-UHFFFAOYSA-N, MFCD16987757, QC-102, ZINC62152694, AKOS016000489, CS-W005296, DS-1311, 4-Bromo-5-methyl-benzene-1,2-diamine, AK118805, AB0031079, AJ-114096, ST2405644, 4CH-018438, FT-0686304, X3416, L-1249, 4-Bromo-5-methyl-1,2-benzenediamine, AldrichCPR, Z2255081760, C7H9BrN2,

Complexity	118
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	199.995g/mol
Formal Charge	0
Heavy Atom Count	10
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	201.067g/mol
Monoisotopic Mass	199.995g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	52A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.6

GHS Hazard and Precautionary Statements

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

Certificate of Analysis

Lot Number