AG0035Z0

16681-65-5 | 1-Methyl-1,2,3-triazole

AG0035Z0

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CAS Number	16681-65-5
Catalog Number	AG0035Z0(AGN-PC-0CZUIV)
Chemical Name	1-Methyl-1,2,3-triazole
IUPAC Name	1-methyltriazole
InChI	InChI=1S/C3H5N3/c1-6-3-2-4-5-6/h2-3H,1H3
InChI Key	JWAWEQBUZOGIBZ-UHFFFAOYSA-N
MDL Number	MFCD09743793
Molecular Formula	C3H5N3
Molecular Weight	83.0919
SMILES	CN1N=NC=C1
Synonyms	1-methyl-1H-1,2,3-triazole, 16681-65-5, 1-Methyl-1,2,3-triazole, 1-METHYLTRIAZOLE, 1H-1,2,3-Triazole, 1-methyl-, MFCD09743793, PubChem23531, AC1L3G9V, CTK4D2458, KS-00000MBH, JWAWEQBUZOGIBZ-UHFFFAOYSA-N, 1-methyl-1H-[1,2,3]triazole, 1H-1,2,3-Triazole,1-methyl-, ZINC6072431, ANW-64174, RW4019, WT1485, AKOS006331669, AB51214, CS-W018672, MCULE-5243651327, QC-3624, RP00360, AJ-55663, AK-60587, CJ-12883, SC-43779, SY045526, AB0040178, DB-064623, ST2408806, TR-007211, 4CH-014572, FT-0652678, Y7754, MFCD09743793 (97%), M-9130, 16681-65-5 1-methyl-1H-1,2,3-triazole, 681M655, H112870, I14-7420, S14-0892, W-205957, Z1729206234, InChI=1/C3H5N3/c1-6-3-2-4-5-6/h2-3H,1H, C3H5N3, CID140119, ACN-026645, A3698,

Complexity	45.3
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	83.048g/mol
Formal Charge	0
Heavy Atom Count	6
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	83.094g/mol
Monoisotopic Mass	83.048g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	30.7A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	-0.3

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H332-H335
Packing Group
Precautionary statements	P261-P280-P305+P351+P338
UN Code

Certificate of Analysis

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