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122852-33-9 | D-Phenylalanine, 4-bromo-, hydrochloride (9CI)
CAS No: 122852-33-9 Catalog No: AG000JLS MDL No:MFCD12759150
Product Description
Catalog Number:
AG000JLS
Chemical Name:
D-Phenylalanine, 4-bromo-, hydrochloride (9CI)
CAS Number:
122852-33-9
Molecular Formula:
C9H11BrClNO2
Molecular Weight:
280.5461
MDL Number:
MFCD12759150
IUPAC Name:
(2R)-2-amino-3-(4-bromophenyl)propanoic acid;hydrochloride
InChI:
InChI=1S/C9H10BrNO2.ClH/c10-7-3-1-6(2-4-7)5-8(11)9(12)13;/h1-4,8H,5,11H2,(H,12,13);1H/t8-;/m1./s1
InChI Key:
GRWMPXZZFAPLFZ-DDWIOCJRSA-N
SMILES:
N[C@@H](C(=O)O)Cc1ccc(cc1)Br.Cl
Properties
Complexity:
179
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
278.966g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
280.546g/mol
Monoisotopic Mass:
278.966g/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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