Phân loại: Reagent,Coupling
Tính chất: EP
Thương hiệu: Angene
CAS Number | 1956-15-6 |
Catalog Number | AG00I3EA(AGN-PC-0O6KSM) |
Chemical Name | L-Phenylalanine, 3-chloro- |
EC Number | 217-797-8 |
IUPAC Name | 2-amino-3-(3-chlorophenyl)propanoic acid |
InChI | InChI=1S/C9H10ClNO2/c10-7-3-1-2-6(4-7)5-8(11)9(12)13/h1-4,8H,5,11H2,(H,12,13) |
InChI Key | JJDJLFDGCUYZMN-UHFFFAOYSA-N |
MDL Number | MFCD05227933 |
Molecular Formula | C9H10ClNO2 |
Molecular Weight | 199.6342 |
SMILES | OC(=O)C(Cc1cccc(c1)Cl)N |
Synonyms |
1956-15-6, 2-amino-3-(3-chlorophenyl)propanoic acid, h-dl-phe(3-cl)-oh, 3-CHLORO-DL-PHENYLALANINE, Phenylalanine,3-chloro-, 2-azanyl-3-(3-chlorophenyl)propanoic acid, L-Phenylalanine, 3-chloro-, 3-Chloro-3-phenylalanine, 3-Chloro-3-phenyl-DL-alanine, EINECS 217-797-8, EINECS 237-940-8, (S)-2-Amino-3-(3-chlorophenyl)propionic acid, 3-Chlorophenylalanine #, AC1Q3M3T, SCHEMBL42993, AC1L39Z8, CTK4C2389, JJDJLFDGCUYZMN-UHFFFAOYSA-N, BCP11546, ANW-63966, MFCD05227933, AKOS000170084, AKOS016843193, AM82743, MCULE-1289187602, TRA0030144, TRA0090984, VZ35047, alpha-Amino-3-chlorobenzenepropionic acid, AK-59198, AK-93785, AK162592, AN-10563, AN-50147, 2-Amino-3-(3-chlorophenyl)propionic acid, TC-152711, Y0536, 956C156, A805013, A839845, 2-AMINO-3-(3-CHLORO-PHENYL)-PROPIONIC ACID, I01-7439, DL-2-AMINO-3-(3-CHLORO-PHENYL)-PROPIONIC ACID, F8887-3973, 3-Chlorophenylalanine, L-3-Chlorophenylalanine, 3-chloro-L-phenylalanine, H-Phe(3-Cl)-OH, D-3-Chlorophenylalanine, H-D-Phe(3-Cl)-OH, 3-Chloro-D-phenylalanine, C9H10ClNO2, DL-PHE(3-CL)-OH, C9-H10-Cl-N-O2, CHEBI:32489, CID85680, AR-1F2767, 2-Amino-3-(3-chlorophenyl)propanoicacid, 80126-52-9, 14091-12-4, 80126-51-8, (R)-2-AMINO-3-(3-CHLOROPHENYL)PROPANOIC ACID, 123053-22-5, 20013-90-5, |
Complexity | 187 |
Compound Is Canonicalized | Yes |
Covalently-Bonded Unit Count | 1 |
Defined Atom Stereocenter Count | 0 |
Defined Bond Stereocenter Count | 0 |
Exact Mass | 199.04g/mol |
Formal Charge | 0 |
Heavy Atom Count | 13 |
Hydrogen Bond Acceptor Count | 3 |
Hydrogen Bond Donor Count | 2 |
Isotope Atom Count | 0 |
Molecular Weight | 199.634g/mol |
Monoisotopic Mass | 199.04g/mol |
Rotatable Bond Count | 3 |
Topological Polar Surface Area | 63.3A^2 |
Undefined Atom Stereocenter Count | 1 |
Undefined Bond Stereocenter Count | 0 |
XLogP3 | -0.5 |
GHS Hazard and Precautionary Statements
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