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151911-23-8 | (R)-3-Amino-3-(4-fluorophenyl)propanoic acid
CAS No: 151911-23-8 Catalog No: AG0038AA MDL No:MFCD03840459
Product Description
Catalog Number:
AG0038AA
Chemical Name:
(R)-3-Amino-3-(4-fluorophenyl)propanoic acid
CAS Number:
151911-23-8
Molecular Formula:
C9H10FNO2
Molecular Weight:
183.1796
MDL Number:
MFCD03840459
IUPAC Name:
(3R)-3-amino-3-(4-fluorophenyl)propanoic acid
InChI:
InChI=1S/C9H10FNO2/c10-7-3-1-6(2-4-7)8(11)5-9(12)13/h1-4,8H,5,11H2,(H,12,13)/t8-/m1/s1
InChI Key:
CPGFMWPQXUXQRX-MRVPVSSYSA-N
SMILES:
N[C@@H](c1ccc(cc1)F)CC(=O)O
Properties
Complexity:
179
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
183.07g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
183.182g/mol
Monoisotopic Mass:
183.07g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
63.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-1.3
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