AG003M5J

28004-62-8 | 5-(4-Chlorophenyl)-1,3,4-thiadiazol-2-amine

AG003M5J

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CAS Number	28004-62-8
Catalog Number	AG003M5J(AGN-PC-0JUO98)
Chemical Name	5-(4-Chlorophenyl)-1,3,4-thiadiazol-2-amine
IUPAC Name	5-(4-chlorophenyl)-1,3,4-thiadiazol-2-amine
InChI	InChI=1S/C8H6ClN3S/c9-6-3-1-5(2-4-6)7-11-12-8(10)13-7/h1-4H,(H2,10,12)
InChI Key	OAVULPOOAHQYDZ-UHFFFAOYSA-N
MDL Number	MFCD00980966
Molecular Formula	C8H6ClN3S
Molecular Weight	211.6713
SMILES	NC1=NN=C(C2=CC=C(Cl)C=C2)S1
Synonyms	5-(4-chlorophenyl)-1,3,4-thiadiazol-2-amine, 28004-62-8, 2-Amino-5-(4-chlorophenyl)-1,3,4-thiadiazole, 5-(4-Chloro-phenyl)-[1,3,4]thiadiazol-2-ylamine, 5-(4-chlorophenyl)-[1,3,4]thiadiazol-2-ylamine, CHEMBL1383520, 1,3,4-Thiadiazol-2-amine, 5-(4-chlorophenyl)-, 5-(4-chlorophenyl)-1,3,4-thiadiazole-2-ylamine, AC1LDK1D, Oprea1_452072, Oprea1_863270, MLS000525910, SCHEMBL1143676, KS-00001KQN, ZINC28531, OAVULPOOAHQYDZ-UHFFFAOYSA-N, HMS2503M07, BBL002951, BDBM50440130, GEO-00104, MFCD00980966, SBB000521, STK101084, AKOS000225420, CCG-104125, FS-2361, MCULE-1841047702, BAS 00600009, BC636530, CJ-00165, SMR000116384, ST041112, ZB000835, AB0056991, TR-040947, EU-0001773, FT-0679212, V4889, 2-Amino-5-(4-chlorophenyl)1,3,4-thiadiazole, K-7032, 2-AMINO-5-(4-CHLOROPHENYL)-1 3 4-, 2-amino-5-(p-chlorophenyl)-1,3,4-thiadiazole, 5-(4-Chlorophenyl)-1,3,4-thiadiazole-2-amine, 004A628, 5-(4-chlorophenyl)-1,3,4-thiadiazol-2-ylamine, A819280, SR-01000402368, SR-01000402368-1, W-200274, 1-(5-Amino-1,3,4-thiadiazol-2-yl)-4-chlorobenzene, 2-Amino-5-(4-chlorophenyl)-1,3,4-thiadiazole, 97%, F0405-1560, C8H6ClN3S, CID668392, ZINC00028531,

Complexity	173
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	210.997g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	211.667g/mol
Monoisotopic Mass	210.997g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	80A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.3

GHS Hazard and Precautionary Statements

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

Certificate of Analysis

Lot Number