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4-(chloromethyl)-1-((5-methylthiophen-2-yl)methyl)-1h-1,2,3-triazole

4-(chloromethyl)-1-((5-methylthiophen-2-yl)methyl)-1h-1,2,3-triazole - CAS 2092475-39-1

Catalog:	BB070432
Product Name:	4-(chloromethyl)-1-((5-methylthiophen-2-yl)methyl)-1h-1,2,3-triazole
CAS:	2092475-39-1
Synonyms:	4-(chloromethyl)-1-((5-methylthiophen-2-yl)methyl)-1H-1,2,3-triazole; 4-(chloromethyl)-1-[(5-methylthiophen-2-yl)methyl]triazole

Technical Data

Computed Properties

IUPAC Name:	4-(chloromethyl)-1-[(5-methylthiophen-2-yl)methyl]triazole
Description:	4-(chloromethyl)-1-((5-methylthiophen-2-yl)methyl)-1H-1,2,3-triazole (cas# 2092475-39-1) is a useful research chemical.
Molecular Weight:	227.71
Molecular Formula:	C9H10ClN3S
Canonical SMILES:	CC1=CC=C(S1)CN2C=C(N=N2)CCl
InChI:	InChI=1S/C9H10ClN3S/c1-7-2-3-9(14-7)6-13-5-8(4-10)11-12-13/h2-3,5H,4,6H2,1H3
InChI Key:	HVOCWQGPDPKJND-UHFFFAOYSA-N

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Complexity:	193
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	227.0283962
Formal Charge:	0
Heavy Atom Count:	14
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	227.0283962
Rotatable Bond Count:	3
Topological Polar Surface Area:	59Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	1.8