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DL-4-Iodophenylalanine

CAT: 0024-sc-476003ASize: 5 gDry Ice: NoHazardous: No
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CAT#:0024-sc-476003ASize:5 g
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CAS Number
14173-41-2

Chemical Information

2-Amino-3-(4-iodophenyl)propionic acid

4-iodophenylalanine is a phenylalanine derivative that is phenylalanine carrying an iodo group at position 4 on the benzene ring. It is a phenylalanine derivative, an organoiodine compound and a non-proteinogenic alpha-amino acid.

CAS Number14173-41-2
PubChem CID5152312
IUPAC Name2-amino-3-(4-iodophenyl)propanoic acid
Molecular FormulaC9H10INO2
Molecular Weight291.09
XLogP-0.9
Topological Polar Surface Area63.3
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count3
Rotatable Bond Count3
Heavy Atom Count13
Formal Charge0
Complexity178
SMILES
C1=CC(=CC=C1CC(C(=O)O)N)I
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)
InChIKey
PZNQZSRPDOEBMS-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 2-Amino-3-(4-iodophenyl)propionic acid
CAS: 14173-41-2
CID: 5152312
Formula: C9H10INO2
MW: 291.09
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight291.09
XLogP3-0.9
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count3
Rotatable Bond Count3
Exact Mass290.97563
Monoisotopic Mass290.97563
Topological Polar Surface Area63.3 Ų
Heavy Atom Count13
Formal Charge0
Complexity178
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes