AG003MOJ

94-97-3 | 5-Chloro-1H-benzo[d][1,2,3]triazole

AG003MOJ

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CAS Number	94-97-3
Catalog Number	AG003MOJ(AGN-PC-0OO04R)
Chemical Name	5-Chloro-1H-benzo[d][1,2,3]triazole
EC Number	202-378-4
IUPAC Name	5-chloro-2H-benzotriazole
InChI	InChI=1S/C6H4ClN3/c7-4-1-2-5-6(3-4)9-10-8-5/h1-3H,(H,8,9,10)
InChI Key	PZBQVZFITSVHAW-UHFFFAOYSA-N
MDL Number	MFCD00005700
Molecular Formula	C6H4ClN3
Molecular Weight	153.5691
SMILES	Clc1cc2c(cc1)[nH]nn2
UNII	8C7O46G78K
Synonyms	5-Chlorobenzotriazole, 94-97-3, 1H-Benzotriazole, 5-chloro-, 5-Chloro-1H-benzo[d][1,2,3]triazole, 6-Chlorobenzotriazole, 5-chloro-2H-benzotriazole, 5-Chloro-1H-benzotriazole, 1H-Benzotriazole, 6-chloro-, 6-Chloro-1H-benzotriazole, UNII-8C7O46G78K, PZBQVZFITSVHAW-UHFFFAOYSA-N, 8C7O46G78K, 5-Chloro-1H-1,2,3-benzotriazole, AK403403, W-100178, NSC16507, 5-chlorobenztriazole, EINECS 202-378-4, NSC 16507, 6-chloro-benzotriazole, ACMC-209run, 5-chlorobenzotriazole ;, AI3-52175, AC1Q3KLM, 5-chloro-1h-benzotriazol, 5-chlorobenzotriazole 99%, 5-chlorobenzotriazole,98%, 5-CHLOROBENZOTRIZOLE, 1h-benzotriazole,5-chloro-, 6-chloro-1-h-benzotriazole, DSSTox_CID_27450, DSSTox_RID_82355, 1H-Benzotriazole,6-chloro-, DSSTox_GSID_47450, 5-Chlorobenzotriazole, 99%, labotest-bb lt00440766, 2H-Benzotriazole, 5-chloro-, BIDD:GT0841, SCHEMBL203784, AC1L263K, CHEMBL3187395, DTXSID0047450, CTK5H7276, PZBQVZFITSVHAW-UHFFFAOYSA-, 6-chloro-1H-1,2,3-benzotriazole, NSC58361, ZINC5425428, ZX-AT013312, Tox21_302472, ANW-40365, BR1276, MFCD00005700, NSC-16507, NSC-58361, OR2344, SBB057534, AKOS005061649, AKOS005061651, 5-Chloro-1H-1,2,3-benzotriazole #, FCH1411774, FS-2550, MCULE-6088917331, CAS-94-97-3, KS-000000W7, NCGC00256833-01, 1185742-20-4, AN-24303, K721, ST096851, SY002109, DB-057544, TC-129110, BB 0243853, BB 0243856, FT-0620198, MFCD00005700 (95%), 005C700, C-36204, I01-19557, InChI=1/C6H4ClN3/c7-4-1-2-5-6(3-4)9-10-8-5/h1-3H,(H,8,9,10), Ethohexadiol, 5-chlorbenzotriazol, Ethylhexylene glycol, C6H4ClN3, 6-chloro-3aH-benzotriazole, C6-H4-Cl-N3, CID66760, c0137, 5-Chlorobenzotriazole, 99% - 100G 100g,

Complexity	130
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	153.009g/mol
Formal Charge	0
Heavy Atom Count	10
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	153.569g/mol
Monoisotopic Mass	153.009g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	41.6A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.7

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302
Packing Group
Precautionary statements	P280-P305+P351+P338
UN Code

Certificate of Analysis

Lot Number