Name: Name:5-chloro-2-[(3-phenylpropyl)amino]benzoic acid
Brand: Angene
SKU: AG01ELK4
Rating: 90 (10 reviews)

5-chloro-2-[(3-phenylpropyl)amino]benzoic acid

CAS No.:

1406474-20-1

Catalog Number:

AG01ELK4

Molecular Formula:

C16H16ClNO2

Molecular Weight:

289.7567

Catalog Number:

AG01ELK4

Chemical Name:

5-chloro-2-[(3-phenylpropyl)amino]benzoic acid

CAS Number:

1406474-20-1

Molecular Formula:

C16H16ClNO2

Molecular Weight:

289.7567

IUPAC Name:

5-chloro-2-(3-phenylpropylamino)benzoic acid

InChI:

InChI=1S/C16H16ClNO2/c17-13-8-9-15(14(11-13)16(19)20)18-10-4-7-12-5-2-1-3-6-12/h1-3,5-6,8-9,11,18H,4,7,10H2,(H,19,20)

InChI Key:

PYVLOOBHYNPWNF-UHFFFAOYSA-N

SMILES:

Clc1ccc(c(c1)C(=O)O)NCCCc1ccccc1

Complexity:

305

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

289.087g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

289.759g/mol

Monoisotopic Mass:

289.087g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

49.3A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

4.9