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14173-41-2 | Phenylalanine, 4-iodo-
CAS No: 14173-41-2 Catalog No: AG001GY0 MDL No:MFCD00063066
Product Description
Catalog Number:
AG001GY0
Chemical Name:
Phenylalanine, 4-iodo-
CAS Number:
14173-41-2
Molecular Formula:
C9H10INO2
Molecular Weight:
291.0857
MDL Number:
MFCD00063066
IUPAC Name:
2-amino-3-(4-iodophenyl)propanoic acid
InChI:
InChI=1S/C9H10INO2/c10-7-3-1-6(2-4-7)5-8(11)9(12)13/h1-4,8H,5,11H2,(H,12,13)
InChI Key:
PZNQZSRPDOEBMS-UHFFFAOYSA-N
SMILES:
N[C@H](C(=O)O)Cc1ccc(cc1)I
Properties
Complexity:
179
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
290.976g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
291.088g/mol
Monoisotopic Mass:
290.976g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
63.3A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.9
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