AG003ROK

105020-39-1 | Methyl 2-methyl-2H-1,2,3-triazole-4-carboxylate

AG003ROK

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CAS Number	105020-39-1
Catalog Number	AG003ROK(AGN-PC-00NPO6)
Chemical Name	Methyl 2-methyl-2H-1,2,3-triazole-4-carboxylate
IUPAC Name	methyl 2-methyltriazole-4-carboxylate
InChI	InChI=1S/C5H7N3O2/c1-8-6-3-4(7-8)5(9)10-2/h3H,1-2H3
InChI Key	DHEGGJDFEGULIC-UHFFFAOYSA-N
MDL Number	MFCD16495898
Molecular Formula	C5H7N3O2
Molecular Weight	141.1280
SMILES	O=C(C1=NN(C)N=C1)OC
Synonyms	105020-39-1, Methyl 2-methyl-2H-1,2,3-triazole-4-carboxylate, METHYL 2-METHYL-1,2,3-TRIAZOLE-4-CARBOXYLATE, 2H-1,2,3-Triazole-4-carboxylicacid,2-methyl-,methylester(9CI), 2H-1,2,3-Triazole-4-carboxylic acid, 2-methyl-, methyl ester, PubChem19254, SCHEMBL864815, CTK8B6091, KS-00000BHE, DTXSID10547678, DHEGGJDFEGULIC-UHFFFAOYSA-N, 1175AA, 2-METHYL-2H-1,2,3-TRIAZOLE-4-CARBOXYLIC ACID METHYL ESTER, ANW-52504, MFCD16495898, ZINC39087320, methyl 2-methyltriazole-4-carboxylate, AKOS016000180, TRA0043821, AJ-98141, AS-31763, CJ-19733, SY008375, DB-059286, TC-141249, FT-0744809, Methyl2-Methyl-1,2,3-triazole-4-carboxylate, MFCD16495898 (98%), K-0475, 2-methyl 2H-1,2,3-triazole-4-carboxylic acid methyl ester, C5H7N3O2, 2H-1,2,3-Triazole-4-carboxylic acid, 2-methyl-, methyl ester (9CI),

Complexity	139
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	141.054g/mol
Formal Charge	0
Heavy Atom Count	10
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	141.13g/mol
Monoisotopic Mass	141.054g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	57A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.4

GHS Hazard and Precautionary Statements

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

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