Ethyl 1H-1,2,3-Triazole-1-carboxylate - CAS 35847-32-6

Catalog:	BB022769
Product Name:	Ethyl 1H-1,2,3-Triazole-1-carboxylate
CAS:	35847-32-6
Synonyms:	1-triazolecarboxylic acid ethyl ester; ethyl triazole-1-carboxylate

Technical Data

Patents

Computed Properties

IUPAC Name:	ethyl triazole-1-carboxylate
Description:	Ethyl 1H-1,2,3-Triazole-1-carboxylate (CAS# 35847-32-6 ) is a useful research chemical.
Molecular Weight:	141.13
Molecular Formula:	C5H7N3O2
Canonical SMILES:	CCOC(=O)N1C=CN=N1
InChI:	InChI=1S/C5H7N3O2/c1-2-10-5(9)8-4-3-6-7-8/h3-4H,2H2,1H3
InChI Key:	YHUXQPLGGYIXNA-UHFFFAOYSA-N
LogP:	0.28270

Publication Number	Title	Priority Date
CN-113166116-A	Amido bridged heterocyclic compound, and composition and application thereof	20190125
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TW-201827431-A	RIP1 kinase inhibitor and method of use thereof	20161216
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KR-20160128428-A	Condensed [1,4]diazepine compounds as autotaxin (atx) and lysophosphatidic acid (lpa) production inhibitors	20140326

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Complexity:	128
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	141.053826475
Formal Charge:	0
Heavy Atom Count:	10
Hydrogen Bond Acceptor Count:	4
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	141.053826475
Rotatable Bond Count:	2
Topological Polar Surface Area:	57
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	0.3