Name: Name:2-amino-3-{[(3-methoxyphenyl)methyl]sulfanyl}propanoic acid
Brand: Angene
SKU: AG01ELMH
Rating: 90 (10 reviews)

2-amino-3-{[(3-methoxyphenyl)methyl]sulfanyl}propanoic acid

CAS No.:

1030621-97-6

Catalog Number:

AG01ELMH

Molecular Formula:

C11H15NO3S

Molecular Weight:

241.3067

Catalog Number:

AG01ELMH

Chemical Name:

2-amino-3-{[(3-methoxyphenyl)methyl]sulfanyl}propanoic acid

CAS Number:

1030621-97-6

Molecular Formula:

C11H15NO3S

Molecular Weight:

241.3067

MDL Number:

MFCD09936092

IUPAC Name:

2-amino-3-[(3-methoxyphenyl)methylsulfanyl]propanoic acid

InChI:

InChI=1S/C11H15NO3S/c1-15-9-4-2-3-8(5-9)6-16-7-10(12)11(13)14/h2-5,10H,6-7,12H2,1H3,(H,13,14)

InChI Key:

MOVFMNSOABLMQN-UHFFFAOYSA-N

SMILES:

COc1cccc(c1)CSCC(C(=O)O)N

NSC Number:

338211

Complexity:

225

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

241.077g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

241.305g/mol

Monoisotopic Mass:

241.077g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

97.8A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

-1.3