Name: Name:3-(chloromethyl)-5H,6H,7H,8H,9H-[1,2,4]triazolo[4,3-a]azepine hydrochloride
Brand: Angene
SKU: AG01BG25
Rating: 90 (10 reviews)

3-(chloromethyl)-5H,6H,7H,8H,9H-[1,2,4]triazolo[4,3-a]azepine hydrochloride

CAS No.:

1803608-94-7

Catalog Number:

AG01BG25

Molecular Formula:

C8H13Cl2N3

Molecular Weight:

222.1149

Catalog Number:

AG01BG25

Chemical Name:

3-(chloromethyl)-5H,6H,7H,8H,9H-[1,2,4]triazolo[4,3-a]azepine hydrochloride

CAS Number:

1803608-94-7

Molecular Formula:

C8H13Cl2N3

Molecular Weight:

222.1149

MDL Number:

MFCD28118807

IUPAC Name:

3-(chloromethyl)-6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepine;hydrochloride

InChI:

InChI=1S/C8H12ClN3.ClH/c9-6-8-11-10-7-4-2-1-3-5-12(7)8;/h1-6H2;1H

InChI Key:

SPVLUCZMZUSYKO-UHFFFAOYSA-N

SMILES:

ClCc1nnc2n1CCCCC2.Cl

Complexity:

153

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

221.049g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

222.113g/mol

Monoisotopic Mass:

221.049g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

30.7A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count: