Name: Name:2-[(1-cyclopentyl-1H-1,2,3,4-tetrazol-5-yl)sulfanyl]acetic acid
Brand: Angene
SKU: AG019K6H
Rating: 90 (10 reviews)

2-[(1-cyclopentyl-1H-1,2,3,4-tetrazol-5-yl)sulfanyl]acetic acid

CAS No.:

531536-55-7

Catalog Number:

AG019K6H

Molecular Formula:

C8H12N4O2S

Molecular Weight:

228.2715

Catalog Number:

AG019K6H

Chemical Name:

2-[(1-cyclopentyl-1H-1,2,3,4-tetrazol-5-yl)sulfanyl]acetic acid

CAS Number:

531536-55-7

Molecular Formula:

C8H12N4O2S

Molecular Weight:

228.2715

MDL Number:

MFCD03566949

IUPAC Name:

2-(1-cyclopentyltetrazol-5-yl)sulfanylacetic acid

InChI:

InChI=1S/C8H12N4O2S/c13-7(14)5-15-8-9-10-11-12(8)6-3-1-2-4-6/h6H,1-5H2,(H,13,14)

InChI Key:

QPWCCVDBCKPKPV-UHFFFAOYSA-N

SMILES:

OC(=O)CSc1nnnn1C1CCCC1

Complexity:

235

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

228.068g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

228.27g/mol

Monoisotopic Mass:

228.068g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

106A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.2