Name: Name:Benzoic acid, 3-[(cyclohexylcarbonyl)amino]-
Brand: Angene
SKU: AG0022IY
Rating: 90 (10 reviews)

Benzoic acid, 3-[(cyclohexylcarbonyl)amino]-

CAS No.:

180991-55-3

Catalog Number:

AG0022IY

Molecular Formula:

C14H17NO3

Molecular Weight:

247.2897

Catalog Number:

AG0022IY

Chemical Name:

Benzoic acid, 3-[(cyclohexylcarbonyl)amino]-

CAS Number:

180991-55-3

Molecular Formula:

C14H17NO3

Molecular Weight:

247.2897

MDL Number:

MFCD00442695

IUPAC Name:

3-(cyclohexanecarbonylamino)benzoic acid

InChI:

InChI=1S/C14H17NO3/c16-13(10-5-2-1-3-6-10)15-12-8-4-7-11(9-12)14(17)18/h4,7-10H,1-3,5-6H2,(H,15,16)(H,17,18)

InChI Key:

UKYBHQDUVKBFFX-UHFFFAOYSA-N

SMILES:

O=C(C1CCCCC1)Nc1cccc(c1)C(=O)O

Complexity:

310

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

247.121g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

247.294g/mol

Monoisotopic Mass:

247.121g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

66.4A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

3.4