Name: Name:2-{[(3-cyanophenyl)methyl](methyl)amino}acetic acid
Brand: Angene
SKU: AG01B937
Rating: 90 (10 reviews)

2-{[(3-cyanophenyl)methyl](methyl)amino}acetic acid

CAS No.:

1153239-29-2

Catalog Number:

AG01B937

Molecular Formula:

C11H12N2O2

Molecular Weight:

204.2252

Catalog Number:

AG01B937

Chemical Name:

2-{[(3-cyanophenyl)methyl](methyl)amino}acetic acid

CAS Number:

1153239-29-2

Molecular Formula:

C11H12N2O2

Molecular Weight:

204.2252

MDL Number:

MFCD12171144

IUPAC Name:

2-[(3-cyanophenyl)methyl-methylamino]acetic acid

InChI:

InChI=1S/C11H12N2O2/c1-13(8-11(14)15)7-10-4-2-3-9(5-10)6-12/h2-5H,7-8H2,1H3,(H,14,15)

InChI Key:

RRMXBNOSLYSEKW-UHFFFAOYSA-N

SMILES:

N#Cc1cccc(c1)CN(CC(=O)O)C

Complexity:

269

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

204.09g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

204.229g/mol

Monoisotopic Mass:

204.09g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

64.3A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

-1.2