Basic information
- CAS
2476729-51-6- Standard SMILES
CC(C)(C)OC(=O)N1[C@H](COCc2ccccc2)COS1(=O)=O- InChIKey
SBDHXVMICOENAK-CYBMUJFWSA-N- Molecular formula
- C15H21NO6S
- Average molar mass
- 343.4 g/mol
Names & identifiers
- Preferred name
- tert-Butyl (R)-4-((benzyloxy)methyl)-1,2,3-oxathiazolidine-3-carboxylate 2,2-dioxide
- IUPAC
- tert-butyl (4R)-2,2-dioxo-4-(phenylmethoxymethyl)oxathiazolidine-3-carboxylate
- English name
- 1,2,3-Oxathiazolidine-3-carboxylic acid, 4-[(phenylmethoxy)methyl]-, 1,1-dimethylethyl ester, 2,2-dioxide, (4R)-
- Molecular formula
- C15H21NO6S
- Molecular weight
- 343.4
Names & synonyms
2476729-51-6tert-Butyl (R)-4-((benzyloxy)methyl)-1,2,3-oxathiazolidine-3-carboxylate 2,2-dioxideMFCD34706057(R)-4-[(Benzyloxy)methyl]-3-Boc-1,2,3-oxathiazolidine 2,2-Dioxide(R)-3-Boc-4-[(benzyloxy)methyl]-1,2,3-oxathiazolidine 2,2-dioxideSCHEMBL29564557WLZ4122AS-97307SY352525F77273F787402tert-butyl (4R)-4-(benzyloxymethyl)-2,2-dioxo-oxathiazolidine-3-carboxylate
Show more names
tert-Butyl(R)-4-((benzyloxy)methyl)-1,2,3-oxathiazolidine-3-carboxylate2,2-dioxide1,2,3-Oxathiazolidine-3-carboxylic acid, 4-[(phenylmethoxy)methyl]-, 1,1-dimethylethyl ester, 2,2-dioxide, (4R)-
Database identifiers
- CAS
2476729-51-6
Properties
Computed structural properties
- XLogP
- 1.9
- Topological polar surface area
- 90.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 6
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 501
Physicochemical properties
- Boiling point
- 428.4 · 428.4±37.0 °C(Predicted)
- Density
- 1.275 · 1.275±0.06 g/cm3(Predicted)
- pka
- -14.33 · -14.33±0.40(Predicted)
Chemistry & industry
Suppliers9 total
南京优氟医药科技有限公司025-86755008 17751752005 · [email protected]
上海皓竹医药科技有限公司18912729622 · [email protected]
毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]
石家庄州昆医药科技有限公司0311-83784138 18633934202 · [email protected]
台州南峰药物研究所[email protected] 13127117265 · [email protected]
韶远科技(上海)有限公司4000665055 · [email protected]
苏州爱玛特生物科技有限公司0512-56316828 400-867-5858;400-867-5858 · [email protected]
上海皓鸿生物医药科技有限公司400-8210725 4008210725 · [email protected]
南京优氟医药科技有限公司025-86755008 17751752005 · [email protected]
Related reactions
0 records
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Compound notes
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