AG003LPJ

29878-31-7 | 4-Methyl-1H-benzo[d][1,2,3]triazole

AG003LPJ

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CAS Number	29878-31-7
Catalog Number	AG003LPJ(AGN-PC-0O8P6W)
Chemical Name	4-Methyl-1H-benzo[d][1,2,3]triazole
EC Number	249-921-1
IUPAC Name	4-methyl-2H-benzotriazole
InChI	InChI=1S/C7H7N3/c1-5-3-2-4-6-7(5)9-10-8-6/h2-4H,1H3,(H,8,9,10)
InChI Key	CMGDVUCDZOBDNL-UHFFFAOYSA-N
MDL Number	MFCD00035800
Molecular Formula	C7H7N3
Molecular Weight	133.1506
SMILES	CC1=C2N=NNC2=CC=C1
UNII	QKK8999IZA
Synonyms	29878-31-7, 4-Methyl-1H-benzotriazole, 4-Methyl-1H-benzo[d][1,2,3]triazole, Tolytriazole, 4-methyl-1H-1,2,3-benzotriazole, 4-METHYLBENZOTRIAZOLE, UNII-QKK8999IZA, 1H-Benzotriazole, 4-methyl-, 1H-Benzotriazole,7-methyl-, QKK8999IZA, CMGDVUCDZOBDNL-UHFFFAOYSA-N, DSSTox_CID_6171, DSSTox_RID_78044, DSSTox_GSID_26171, CAS-29385-43-1, Teltolytriazole, EINECS 249-921-1, Tolyltriazole (Granular), 4-methyl-2H-benzotriazole, Tolyltriazole 99.0% min, AC1L3UP7, AC1Q4W7M, SCHEMBL107037, SCHEMBL446696, CHEMBL3184205, CTK4G3995, DTXSID50274037, Methyl-1H-benzotriazole(mixture), ALBB-005409, ZINC5116315, ZX-AN005334, ZX-CM000479, Tox21_201321, Tox21_303186, ANW-26720, FCH832730, MFCD00035800, STK503394, AKOS023092909, 7-Methyl-1H-1,2,3-benzotriazole #, FS-5046, MCULE-4388838335, OR18853, RP20063, TRA0090442, ACM29878317, 7-methyl-1H-benzo[d][1,2,3]triazole, NCGC00249024-01, NCGC00249024-02, NCGC00256993-01, NCGC00258873-01, AJ-53146, AX8171746, TX-010917, BB 0254273, FT-0638850, FT-0671521, 4-Methyl-1H-benzotriazole, analytical standard, Y-9657, AB01319782-02, UNII-5G7U316H8L component CMGDVUCDZOBDNL-UHFFFAOYSA-N, Tolyltriazole, 4-Tolyltriazole, Retinylglucose, Tolyl triazole, Methylbenzotriazole, Methyl-1H-benzotriazole, C7-H7-N3, AR-1L6982, CID122499, 1H-Benzotriazole, 4(or 5)-methyl-, 1H-Benzotriazole, 6(or 7)-methyl-, 29385-43-1, 3071-32-7, TTA,

Complexity	126
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	133.064g/mol
Formal Charge	0
Heavy Atom Count	10
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	133.154g/mol
Monoisotopic Mass	133.064g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	41.6A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.4

GHS Hazard and Precautionary Statements

Symbol:
Hazard statements	H302+H332-H319-H412
Precuationary statements	P273-P305+P351+P338
Siginal words

Certificate of Analysis

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