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1241680-31-8 | D-Phenylalanine, 3,5-dichloro-
CAS No: 1241680-31-8 Catalog No: AG000LM5 MDL No:MFCD07372030
Product Description
Catalog Number:
AG000LM5
Chemical Name:
D-Phenylalanine, 3,5-dichloro-
CAS Number:
1241680-31-8
Molecular Formula:
C9H9Cl2NO2
Molecular Weight:
234.0793
MDL Number:
MFCD07372030
IUPAC Name:
(2R)-2-amino-3-(3,5-dichlorophenyl)propanoic acid
InChI:
InChI=1S/C9H9Cl2NO2/c10-6-1-5(2-7(11)4-6)3-8(12)9(13)14/h1-2,4,8H,3,12H2,(H,13,14)/t8-/m1/s1
InChI Key:
UAODYKLBUMXKDC-MRVPVSSYSA-N
SMILES:
N[C@@H](C(=O)O)Cc1cc(Cl)cc(c1)Cl
Properties
Complexity:
203
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
233.001g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
234.076g/mol
Monoisotopic Mass:
233.001g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
63.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.2
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