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1241677-87-1 | D-Phenylalanine, 3-iodo-
CAS No: 1241677-87-1 Catalog No: AG000LMC MDL No:MFCD08458532
Product Description
Catalog Number:
AG000LMC
Chemical Name:
D-Phenylalanine, 3-iodo-
CAS Number:
1241677-87-1
Molecular Formula:
C9H10INO2
Molecular Weight:
291.0857
MDL Number:
MFCD08458532
IUPAC Name:
(2R)-2-amino-3-(3-iodophenyl)propanoic acid
InChI:
InChI=1S/C9H10INO2/c10-7-3-1-2-6(4-7)5-8(11)9(12)13/h1-4,8H,5,11H2,(H,12,13)/t8-/m1/s1
InChI Key:
BABTYIKKTLTNRX-MRVPVSSYSA-N
SMILES:
OC(=O)[C@@H](Cc1cccc(c1)I)N
Properties
Complexity:
187
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
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:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.9
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