Name: Name:4-(((3,3-dimethylbutan-2-yl)amino)methyl)benzoic acid
Brand: Angene
SKU: AG00ABMM
Rating: 90 (10 reviews)

4-(((3,3-dimethylbutan-2-yl)amino)methyl)benzoic acid

CAS No.:

1569537-18-3

Catalog Number:

AG00ABMM

Molecular Formula:

C14H21NO2

Molecular Weight:

235.3220

Catalog Number:

AG00ABMM

Chemical Name:

4-(((3,3-dimethylbutan-2-yl)amino)methyl)benzoic acid

CAS Number:

1569537-18-3

Molecular Formula:

C14H21NO2

Molecular Weight:

235.3220

MDL Number:

MFCD27724671

IUPAC Name:

4-[(3,3-dimethylbutan-2-ylamino)methyl]benzoic acid

InChI:

InChI=1S/C14H21NO2/c1-10(14(2,3)4)15-9-11-5-7-12(8-6-11)13(16)17/h5-8,10,15H,9H2,1-4H3,(H,16,17)

InChI Key:

MZFNSUBLEYTXHW-UHFFFAOYSA-N

SMILES:

CC(C(C)(C)C)NCc1ccc(cc1)C(=O)O

Complexity:

249

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

235.157g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

235.327g/mol

Monoisotopic Mass:

235.157g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

49.3A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

0.7