Name: Name:Benzoic acid, 4-[[(5,6,7,8-tetrahydro-1-naphthalenyl)amino]methyl]-
Brand: Angene
SKU: AG0055LQ
Rating: 90 (10 reviews)

Benzoic acid, 4-[[(5,6,7,8-tetrahydro-1-naphthalenyl)amino]methyl]-

CAS No.:

833484-92-7

Catalog Number:

AG0055LQ

Molecular Formula:

C18H19NO2

Molecular Weight:

281.3490

Catalog Number:

AG0055LQ

Chemical Name:

Benzoic acid, 4-[[(5,6,7,8-tetrahydro-1-naphthalenyl)amino]methyl]-

CAS Number:

833484-92-7

Molecular Formula:

C18H19NO2

Molecular Weight:

281.3490

MDL Number:

MFCD28968271

IUPAC Name:

4-[(5,6,7,8-tetrahydronaphthalen-1-ylamino)methyl]benzoic acid

InChI:

InChI=1S/C18H19NO2/c20-18(21)15-10-8-13(9-11-15)12-19-17-7-3-5-14-4-1-2-6-16(14)17/h3,5,7-11,19H,1-2,4,6,12H2,(H,20,21)

InChI Key:

WQSUESHUYSPBQE-UHFFFAOYSA-N

SMILES:

OC(=O)c1ccc(cc1)CNc1cccc2c1CCCC2

Complexity:

349

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

281.142g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

281.355g/mol

Monoisotopic Mass:

281.142g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

49.3A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

4.3