AG003EH3

499785-52-3 | Ethyl 1-methyl-1H-benzo[d][1,2,3]triazole-5-carboxylate

AG003EH3

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CAS Number	499785-52-3
Catalog Number	AG003EH3(AGN-PC-0KLR38)
Chemical Name	Ethyl 1-methyl-1H-benzo[d][1,2,3]triazole-5-carboxylate
IUPAC Name	ethyl 1-methylbenzotriazole-5-carboxylate
InChI	InChI=1S/C10H11N3O2/c1-3-15-10(14)7-4-5-9-8(6-7)11-12-13(9)2/h4-6H,3H2,1-2H3
InChI Key	GMCVREKRSCYEPQ-UHFFFAOYSA-N
MDL Number	MFCD04110946
Molecular Formula	C10H11N3O2
Molecular Weight	205.2132
SMILES	C[N]1C2=C(N=N1)C=C(C=C2)C(=O)OCC
Synonyms	499785-52-3, ethyl 1-methyl-1H-benzo[d][1,2,3]triazole-5-carboxylate, ethyl 1-methyl-1H-1,2,3-benzotriazole-5-carboxylate, ethyl 1-methylbenzotriazole-5-carboxylate, Ethyl 1-methyl-1H-benzotriazole-5-carboxylate, AC1ME7PS, Maybridge3_004451, CTK4J1902, DTXSID60384959, HMS1443K07, ZINC161821, ANW-50542, MFCD04110946, SBB093484, AKOS015850875, CCG-249539, DS-0776, EBD2127037, MCULE-5913282605, RP26163, SDCCGMLS-0066157.P001, IDI1_015838, KS-0000028G, AJ-15807, AK-32033, BR-32033, CJ-01997, EN002261, ZB007681, AB0025129, TR-017910, 4CH-007263, FT-0625836, ST24030427, W6540, S-4548, ethyl 1-methyl-1,2,3-benzotriazole-5-carboxylate, J-520547, I14-10832, 1-Methyl-1H-benzotriazole-5-carboxylic acid ethyl ester, C10H11N3O2, ZINC00161821, CID2824048, ETHYL1-METHYL-1H-1,2,3-BENZOTRIAZOLE-5-CARBOXYLATE, Ethyl1-methyl-1H-benzo[d][1,2,3]triazole-5-carboxylate,

Complexity	247
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	205.085g/mol
Formal Charge	0
Heavy Atom Count	15
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	205.217g/mol
Monoisotopic Mass	205.085g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	57A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.3

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

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