(1H-1,2,3-Triazol-4-yl)methanamine Hydrochloride - CAS 1009101-70-5

Catalog:	BB075675
Product Name:	(1H-1,2,3-Triazol-4-yl)methanamine Hydrochloride
CAS:	1009101-70-5
Synonyms:	(1H-1,2,3-Triazol-4-yl)methanamine hydrochloride; 1H-[1,2,3]Triazol-4-ylmethylamine HCl; (1H-1,2,3-Triazol-5-yl)methanamine hydrochloride; 2H-triazol-4-ylmethanamine; hydrochloride; 1H-[1,2,3]TRIAZOL-4-YLMETHYLAMINE HYDROCHLORIDE; C-(1H-[1,2,3]TRIAZOL-4-YL)-METHYLAMINE HYDROCHLORIDE; 1H-1,2,3-Triazole-5-methanamine, hydrochloride (1:1)

Technical Data

IUPAC Name:	2H-triazol-4-ylmethanaminehydrochloride
Description:	(1H-1,2,3-Triazol-4-yl)methanamine is used in the preparation of matrix metalloprotease (MMP) inhibitors.
Molecular Weight:	134.57
Molecular Formula:	C3H7ClN4
Canonical SMILES:	C1=NNN=C1CN.Cl
InChI:	InChI=1S/C3H6N4.ClH/c4-1-3-2-5-7-6-3/h2H,1,4H2,(H,5,6,7)1H
InChI Key:	OEEMEPMSCVBCQI-UHFFFAOYSA-N

Complexity:	54.9
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	2
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	134.0359239
Formal Charge:	0
Heavy Atom Count:	8
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	3
Isotope Atom Count:	0
Monoisotopic Mass:	134.0359239
Rotatable Bond Count:	1
Topological Polar Surface Area:	67.6Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0