| CAS Number | 201351-59-9 |
| Catalog Number | AG002DD0(AGN-PC-0QS31A) |
| Chemical Name | Ac-p-iodo-d-phe-oh |
| IUPAC Name | (2R)-2-acetamido-3-(4-iodophenyl)propanoic acid |
| InChI | InChI=1S/C11H12INO3/c1-7(14)13-10(11(15)16)6-8-2-4-9(12)5-3-8/h2-5,10H,6H2,1H3,(H,13,14)(H,15,16)/t10-/m1/s1 |
| InChI Key | RTVNNJWKXVLALU-SNVBAGLBSA-N |
| MDL Number | MFCD00236759 |
| Molecular Formula | C11H12INO3 |
| Molecular Weight | 333.1223 |
| SMILES | CC(N[C@@H](C(O)=O)CC1=CC=C(I)C=C1)=O |
| Synonyms | AC-P-IODO-D-PHE-OH,
201351-59-9,
D-Phenylalanine,N-acetyl-4-iodo-,
Acetyl-4-iodo-D-phenylalanine,
AC1OCUU5,
C11H12INO3,
CTK4E3372,
ZINC399561,
D-Phenylalanine, N-acetyl-4-iodo-,
6109AH,
MFCD00236759,
AKOS027250992,
ACM201351599,
RT-011180,
K-5889,
(2R)-2-acetamido-3-(4-iodophenyl)propanoic acid,
CID6950976,
2-acetamido-3-(4-iodophenyl)propanoic Acid,
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| Complexity | 262 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 1 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 332.986g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 16 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 333.125g/mol |
| Monoisotopic Mass | 332.986g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 66.4A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.3 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number