Vitas-M small molecule compound

methyl 5-chloro-1H-1,2,3-triazole-4-carboxylate

Catalog ID
STK774050
SMILES COC(=O)c1nn[nH]c1Cl

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C4H4ClN3O2 MW 161.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C4H4ClN3O2/c1-10-4(9)2-3(5)7-8-6-2/h1H3,(H,6,7,8)
InChIKey
FTUOGIDBNRPVFI-UHFFFAOYSA-N
Synonyms
88474-33-3
1H123TRIAZOLE4CARBOXYLICACID5CHLOROMETHYLESTER
5CHLORO1H(123)TRIAZOLE4CARBOXYLICACIDME
5CHLORO1H(123)TRIAZOLE4CARBOXYLICACIDMETHYLESTER
5CHLORO1H123TRIAZOLE4CARBOXYLICACIDMETHYLESTER
88474333
COC(=O)C1=NNN=C1Cl
COC(=O)c1nn(nH)c1Cl
InChI=1SC4H4ClN3O2c1104(9)23(5)7862h1H3(H678)
methyl5chloro1H123triazole4carboxylate
METHYL5CHLORO2H123TRIAZOLE4CARBOXYLATE
METHYL5CHLORO2HTRIAZOLE4CARBOXYLATE
MFCD01678706
ZINC000001235058
ZINC01235058
ZINC1235058

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.