AG001B65

139512-70-2 | 1,2-Benzenediamine, 4-chloro-5-fluoro-

AG001B65

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CAS Number	139512-70-2
Catalog Number	AG001B65(AGN-PC-0JVO1M)
Chemical Name	1,2-Benzenediamine, 4-chloro-5-fluoro-
IUPAC Name	4-chloro-5-fluorobenzene-1,2-diamine
InChI	InChI=1S/C6H6ClFN2/c7-3-1-5(9)6(10)2-4(3)8/h1-2H,9-10H2
InChI Key	BSMPRJISGCTCDC-UHFFFAOYSA-N
MDL Number	MFCD00042485
Molecular Formula	C6H6ClFN2
Molecular Weight	160.5766
SMILES	NC1=C(N)C=C(Cl)C(F)=C1
Synonyms	4-chloro-5-fluoro-1,2-phenylenediamine, 4-chloro-5-fluorobenzene-1,2-diamine, 139512-70-2, 1,2-Diamino-4-chloro-5-fluorobenzene, 4-chloro-5-fluoro-O-phenylenediamine, 4-Chloro-1,2-diamino-5-fluorobenzene, 4-Chloro-5-fluoro-1,2-phenylenediamine, 1,2-Benzenediamine,4-chloro-5-fluoro-, 1,2-Benzenediamine, 4-chloro-5-fluoro-, MFCD00042485, 1-Chloro-4,5-diamino-2-fluorobenzene, 5-chloro-4-fluorobenzene-1,2-diamine, AC1LEGMH, timtec-bb sbb003959, buttpark 44\03-90, ACMC-209cj7, SCHEMBL404239, AC1Q513F, CTK4C1839, KS-00000KPV, BSMPRJISGCTCDC-UHFFFAOYSA-N, ZINC152701, ACT12726, ANW-20513, SBB003959, 4-chloro-5fluoro-1,2-diaminobenzene, AKOS006227965, 4-Fluoro-5-chlorobenzene-1,2-diamine, PS-8767, RP02151, RTC-060842, VZ28670, 4-chloro-5-fluoro-benzene-1,2-diamine, 4-Cloro-5-fluoro-1,2-phenylenediamine, 4-Chloro-5-fluorophenylene-1,2-diamine, 5-Chloro-4-fluorophenylene-1,2-diamine, AC-26077, AJ-12790, AK-59043, BP-20089, CJ-01178, ZB005229, ST2411311, TC-060842, CS-0028764, FT-0618115, ST50307790, X2920, A20802, C-5448, 4-Chloro-1,2-diamino-5-fluorobenzene, AldrichCPR, W-205534, I01-15720, F0001-0479, C6H6ClFN2, CID735773, ZINC00152701, 4-Chloro-5-fluorobenzene-1,2-diamine dihydrochloride, 132942-81-5,

Complexity	122
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	160.02g/mol
Formal Charge	0
Heavy Atom Count	10
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	160.576g/mol
Monoisotopic Mass	160.02g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	52A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.5

GHS Hazard and Precautionary Statements

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

Certificate of Analysis

Lot Number