| CAS Number | 1217609-39-6 |
| Catalog Number | AG0015UL(AGN-PC-0WAJ7Y) |
| Chemical Name | (R)-2-Amino-3-(4-Carbamoylphenyl)Propanoic Acid |
| IUPAC Name | (2R)-2-amino-3-(4-carbamoylphenyl)propanoic acid |
| InChI | InChI=1S/C10H12N2O3/c11-8(10(14)15)5-6-1-3-7(4-2-6)9(12)13/h1-4,8H,5,11H2,(H2,12,13)(H,14,15)/t8-/m1/s1 |
| InChI Key | OZVAXCWACWDNIQ-MRVPVSSYSA-N |
| MDL Number | MFCD06659105 |
| Molecular Formula | C10H12N2O3 |
| Molecular Weight | 208.2139 |
| SMILES | N[C@H](CC1=CC=C(C=C1)C(N)=O)C(O)=O |
| Synonyms | 1217609-39-6,
(R)-2-Amino-3-(4-carbamoylphenyl)propanoic acid,
(2R)-2-amino-3-(4-carbamoylphenyl)propanoic Acid,
D-4-Carbamoylphe,
D-4-CARBAMOYLPHENYLALANINE,
AC1OGBFS,
DTXSID00428043,
ZINC4241956,
3987AA,
MFCD06659105,
D-Phenylalanine, 4-(aminocarbonyl)-,
AJ-49502,
PS-12793,
AX8245646,
(2R)-2-amino-3-(4-carbamoylphenyl)propionic acid,
(2R)-3-(4-aminocarbonylphenyl)-2-azanyl-propanoic acid,
C10H12N2O3,
CID7146232,
(R)-2-Amino-3-(4-carbamoylphenyl)propanoicacid,
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| Complexity | 247 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 1 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 208.085g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 3 |
| Isotope Atom Count | 0 |
| Molecular Weight | 208.217g/mol |
| Monoisotopic Mass | 208.085g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 106A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | -2.2 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
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