Name: Name:4-[(N,2-dimethylpropanamido)methyl]benzoic acid
Brand: Angene
SKU: AG01AKY4
Rating: 90 (10 reviews)

4-[(N,2-dimethylpropanamido)methyl]benzoic acid

CAS No.:

1183845-86-4

Catalog Number:

AG01AKY4

Molecular Formula:

C13H17NO3

Molecular Weight:

235.2790

Catalog Number:

AG01AKY4

Chemical Name:

4-[(N,2-dimethylpropanamido)methyl]benzoic acid

CAS Number:

1183845-86-4

Molecular Formula:

C13H17NO3

Molecular Weight:

235.2790

MDL Number:

MFCD13238281

IUPAC Name:

4-[[methyl(2-methylpropanoyl)amino]methyl]benzoic acid

InChI:

InChI=1S/C13H17NO3/c1-9(2)12(15)14(3)8-10-4-6-11(7-5-10)13(16)17/h4-7,9H,8H2,1-3H3,(H,16,17)

InChI Key:

OZRIGBUKQICXAE-UHFFFAOYSA-N

SMILES:

CC(C(=O)N(Cc1ccc(cc1)C(=O)O)C)C

Complexity:

280

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

235.121g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

235.283g/mol

Monoisotopic Mass:

235.121g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

57.6A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.8