Name: Name:(S)-3-amino-3-(3-chloro-5-methoxyphenyl)propanoic acid
Brand: Angene
SKU: AG01DD0G
Rating: 90 (10 reviews)

(S)-3-amino-3-(3-chloro-5-methoxyphenyl)propanoic acid

CAS No.:

2061996-84-5

Catalog Number:

AG01DD0G

Molecular Formula:

C10H12ClNO3

Molecular Weight:

229.6602

Catalog Number:

AG01DD0G

Chemical Name:

(S)-3-amino-3-(3-chloro-5-methoxyphenyl)propanoic acid

CAS Number:

2061996-84-5

Molecular Formula:

C10H12ClNO3

Molecular Weight:

229.6602

MDL Number:

MFCD30609569

IUPAC Name:

(3S)-3-amino-3-(3-chloro-5-methoxyphenyl)propanoic acid;hydrochloride

InChI:

InChI=1S/C10H12ClNO3.ClH/c1-15-8-3-6(2-7(11)4-8)9(12)5-10(13)14;/h2-4,9H,5,12H2,1H3,(H,13,14);1H/t9-;/m0./s1

InChI Key:

UNSVDYBHADSVOU-FVGYRXGTSA-N

SMILES:

COc1cc(Cl)cc(c1)[C@H](CC(=O)O)N

Complexity:

225

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

265.027g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

266.118g/mol

Monoisotopic Mass:

265.027g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

72.6A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count: