Name: Name:1-[[4-(Trifluoromethyl)phenyl]carbonyl]-4-piperidinecarboxylic acid
Brand: Angene
SKU: AG00G71Y
Rating: 90 (10 reviews)

1-[[4-(Trifluoromethyl)phenyl]carbonyl]-4-piperidinecarboxylic acid

CAS No.:

856215-36-6

Catalog Number:

AG00G71Y

Molecular Formula:

C14H14F3NO3

Molecular Weight:

301.2611

Catalog Number:

AG00G71Y

Chemical Name:

1-[[4-(Trifluoromethyl)phenyl]carbonyl]-4-piperidinecarboxylic acid

CAS Number:

856215-36-6

Molecular Formula:

C14H14F3NO3

Molecular Weight:

301.2611

MDL Number:

MFCD08525736

IUPAC Name:

1-[4-(trifluoromethyl)benzoyl]piperidine-4-carboxylic acid

InChI:

InChI=1S/C14H14F3NO3/c15-14(16,17)11-3-1-9(2-4-11)12(19)18-7-5-10(6-8-18)13(20)21/h1-4,10H,5-8H2,(H,20,21)

InChI Key:

KWFBUWDESLAMET-UHFFFAOYSA-N

SMILES:

O=C(c1ccc(cc1)C(F)(F)F)N1CCC(CC1)C(=O)O

Complexity:

395

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

301.093g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

301.265g/mol

Monoisotopic Mass:

301.093g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

57.6A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.3