English
(S)-3-amino-3-(4-methoxyphenyl)propanoic acid
Phân loại: Reagent,Coupling ,Amino acid
Tính chất: EP
Thương hiệu: Angene
| CAS Number | 131690-56-7 |
| Catalog Number | AG000ZKS(AGN-PC-0PJK6D) |
| Chemical Name | Benzenepropanoic acid, β-amino-4-methoxy-, (βS)- |
| IUPAC Name | (3S)-3-amino-3-(4-methoxyphenyl)propanoic acid |
| InChI | InChI=1S/C10H13NO3/c1-14-8-4-2-7(3-5-8)9(11)6-10(12)13/h2-5,9H,6,11H2,1H3,(H,12,13)/t9-/m0/s1 |
| InChI Key | NYTANCDDCQVQHG-VIFPVBQESA-N |
| MDL Number | MFCD04113698 |
| Molecular Formula | C10H13NO3 |
| Molecular Weight | 195.2151 |
| SMILES | COc1ccc(cc1)[C@H](CC(=O)O)N |
| Synonyms |
131690-56-7, (S)-3-amino-3-(4-methoxyphenyl)propanoic acid, (s)-3-amino-3-(4-methoxy-phenyl)-propionic acid, (S)-beta-(p-methoxyphenyl)alanine, (3S)-3-amino-3-(4-methoxyphenyl)propanoic acid, (s)-3-amino-3-(4-methoxyphenyl)propionic acid, s-3-amino-3-(4-methoxy-phenyl)-propionic acid, (s)-3-(p-methoxyphenyl)-beta-alanine, (S)-beta-(4-Methoxyphenyl)alanine, Benzenepropanoic acid, b-amino-4-methoxy-, (bS)-, h-beta-phe(4-ome)-oh, AC1LECR0, h-d-phg(4-ome)-(c*ch2)oh, SCHEMBL7104579, CTK4B7448, ZINC50501, (s)-b-(p-methoxyphenyl)-b-alanine, ACT08157, BENZENEPROPANOIC ACID, BETA-AMINO-4-METHOXY-, (BETAS)-, ANW-61192, MFCD04113698, AB17827, AC-6599, CM-1109, MCULE-4530719110, (S)-3-(4-Methoxyphenyl)-beta-alanine, AJ-09100, AK-57664, AS-38045, BBV-32460855, SC-65965, AB0004981, AX8031742, TC-149937, FT-0630336, Z5633, (S)-3 -(P-METHOXYPHENYL)-BETA-ALANINE, (S)-3-Amino-3-(4-methoxyphenyl)propionicacid, EN300-152105, X-2277, (s)-3-amino-3-(4-methoxy-phenyl)-propanoic acid, 690A567, (R)- 3-Amino-3-(4-methoxyphenyl)-propionic acid, I01-8243, (s)-beta-amino-beta-(4-methoxyphenyl) propionic acid, C10H13NO3, ZERO/001586, CID684097, ACN-025978, (S)-3-Amino-3-(4-methoxyphenyl)propanoicacid, |
CHI TIẾT :
| Complexity | 188 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 1 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 195.09g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 195.218g/mol |
| Monoisotopic Mass | 195.09g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 72.6A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | -1.4 |
GHS Hazard and Precautionary Statements
| Symbol: |  |
| Hazard statements | H315-H319-H335 |
| Precuationary statements | P261-P305+P351+P338 |
| Siginal words |