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Home > Fluorides > 122839-51-4
122839-51-4 | D-Phenylalanine, 2-fluoro-, hydrochloride (1:1)
CAS No: 122839-51-4 Catalog No: AG000JK6 MDL No:MFCD00066447
Product Description
Catalog Number:
AG000JK6
Chemical Name:
D-Phenylalanine, 2-fluoro-, hydrochloride (1:1)
CAS Number:
122839-51-4
Molecular Formula:
C9H11ClFNO2
Molecular Weight:
219.6405
MDL Number:
MFCD00066447
IUPAC Name:
(2R)-2-amino-3-(2-fluorophenyl)propanoic acid;hydrochloride
InChI:
InChI=1S/C9H10FNO2.ClH/c10-7-4-2-1-3-6(7)5-8(11)9(12)13;/h1-4,8H,5,11H2,(H,12,13);1H/t8-;/m1./s1
InChI Key:
YSTOPARNEYKWBQ-DDWIOCJRSA-N
SMILES:
OC(=O)[C@@H](Cc1ccccc1F)N.Cl
Properties
Complexity:
187
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
219.046g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
219.64g/mol
Monoisotopic Mass:
219.046g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
63.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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