Name: Name:1H-1,2,3-Triazole-4-carboxylic acid, 1-cyclohexyl-
Brand: Angene
SKU: AG0014Q3
Rating: 90 (10 reviews)

1H-1,2,3-Triazole-4-carboxylic acid, 1-cyclohexyl-

CAS No.:

1333542-85-0

Catalog Number:

AG0014Q3

Molecular Formula:

C9H13N3O2

Molecular Weight:

195.2184

Catalog Number:

AG0014Q3

Chemical Name:

1H-1,2,3-Triazole-4-carboxylic acid, 1-cyclohexyl-

CAS Number:

1333542-85-0

Molecular Formula:

C9H13N3O2

Molecular Weight:

195.2184

MDL Number:

MFCD11619028

IUPAC Name:

1-cyclohexyltriazole-4-carboxylic acid

InChI:

InChI=1S/C9H13N3O2/c13-9(14)8-6-12(11-10-8)7-4-2-1-3-5-7/h6-7H,1-5H2,(H,13,14)

InChI Key:

OHQZQJMGYRDNTQ-UHFFFAOYSA-N

SMILES:

OC(=O)c1nnn(c1)C1CCCCC1

Complexity:

216

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

195.101g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

195.222g/mol

Monoisotopic Mass:

195.101g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

68A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.3