| Identification | Back Directory | [Name]
(S)-3-((tert-Butoxycarbonyl)amino)-2-(4-chlorophenyl)propanoic acid | [CAS]
116112-80-2 | [Synonyms]
4-[(2,3,4,6-tetra-O-acetyl-β-D-galactopyranosyl)oxy]-Butanoic acid
Butanoic acid, 4-[(2,3,4,6-tetra-O-acetyl-β-D-galactopyranosyl)oxy]-
4-?[(2,?3,?4,?6-?Tetra-?O-?acetyl-?β-?D-?galactopyranosyl)?oxy]?butanoic acid | [Molecular Formula]
C18H26O12 | [MOL File]
116112-80-2.mol | [Molecular Weight]
434.39 |
| Chemical Properties | Back Directory | [Boiling point ]
534.9±50.0 °C(Predicted) | [density ]
1.32±0.1 g/cm3(Predicted) | [pka]
4.61±0.10(Predicted) | [InChI]
InChI=1/C18H26O12/c1-9(19)26-8-13-15(27-10(2)20)16(28-11(3)21)17(29-12(4)22)18(30-13)25-7-5-6-14(23)24/h13,15-18H,5-8H2,1-4H3,(H,23,24)/t13-,15+,16+,17-,18-/s3 | [InChIKey]
YWFYYAPQJAVDIL-NGHDZHTCNA-N | [SMILES]
O([C@@H]1[C@H]([C@H](OCCCC(=O)O)O[C@H](COC(=O)C)[C@@H]1OC(=O)C)OC(=O)C)C(=O)C |&1:1,2,3,12,18,r| |
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