Basic information
- CAS
74094-05-6- Standard SMILES
C[C@@H](O)C(=O)OCc1ccccc1- InChIKey
ZYTLPUIDJRKAAM-MRVPVSSYSA-N- Molecular formula
- C10H12O3
- Average molar mass
- 180.2 g/mol
- Monoisotopic mass
- 180.07864424
Names & identifiers
- Preferred name
- (R)-2-hydroxypropionic acid benzyl ester
- IUPAC
- benzyl (2R)-2-hydroxypropanoate
- English name
- D-Lactic acid-benzyl ester
- Molecular formula
- C10H12O3
- Molecular weight
- 180.2
Names & synonyms
74094-05-6(R)-2-hydroxypropionic acid benzyl esterDTXSID60415939RefChem:210881DTXCID90366788D-Lactic acid-benzyl esterBenzyl (R)-2-hydroxypropanoatebenzyl (2R)-2-hydroxypropanoateH-D-LAC-OBZLBenzyl (R)-LactateMFCD00672497(R)-Benzyl 2-hydroxypropanoate
Show more names
Perindopril Impurity 95
d-lactic acid benzyl ester(r)-benzyllactate(R)-2-Phenylmethyl hydroxypropanoate(R)-lactic acid benzyl esterSCHEMBL1107604(R)-Benzyl 2-hydroxypropionatePropanoic acid, 2-hydroxy-, phenylmethyl ester, (2R)-ZYTLPUIDJRKAAM-MRVPVSSYSA-N
Database identifiers
- CAS
74094-05-6- PubChem CID
- 5324736
- DTXSID
DTXSID60415939- Nikkaji
- J70.600K
Properties
Computed structural properties
- XLogP
- 1.4
- Topological polar surface area
- 46.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 162
Physicochemical properties
- Boiling point
- 280.5 · 280.5±15.0 °C(Predicted)
- Density
- 1.15 · 1.150±0.06 g/cm3(Predicted)
- storage temp.
- 2 · 2-8°C
- pka
- 13.03 · 13.03±0.20(Predicted)
- Appearance
- Colorless to light yellow Liquid
- InChI
- InChI=1S/C10H12O3/c1-8(11)10(12)13-7-9-5-3-2-4-6-9/h2-6,8,11H,7H2,1H3/t8-/m1/s1
- InChIKey
- ZYTLPUIDJRKAAM-MRVPVSSYSA-N
- SMILES
- C(OCC1=CC=CC=C1)(=O)[C@H](O)C
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 261 · P261-P305+P351+P338
Safety & regulation
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P261-P305+P351+P338
Chemistry & industry
Suppliers26 total
陕西缔都医药有限责任公司029-81124775 17791530730 · [email protected]
韶远科技(上海)有限公司021-50795510 4000665055 · [email protected]
毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]
上海毕得医药科技股份有限公司400-1647117 13681763483 · [email protected]
Suzhou ARTK Medchem Co., Ltd.+86-18168183658 · [email protected]
梯希爱（上海）化工贸易有限公司021-61109150 · [email protected]
凯试(上海)科技有限公司021-50135380 · [email protected]
山西百利恒康医药科技有限公司19135651983 19135651206 · [email protected]
HANGZHOU LEAP CHEM CO., LTD.+86-571-87711850 +86-15355479329 · [email protected]
嘉兴市德亿化工有限公司0573-85866609 13325730825 · [email protected]
重庆艾思摩尔科技有限公司023-86822659 18611316925 · [email protected]
上海缮远医药科技有限公司021-31761238 13167072949 · [email protected]
上海英奇曼化学科技有限公司18299177127 · [email protected]
湖北扬信医药科技有限公司15374522761 · [email protected]
Related reactions
2 records
Compound notes
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