tert-butyl (4S)-2,2-dioxo-4-phenyl-1,2lambda6,3-oxathiazolidine-3-carboxylate
Basic information
- CAS
479687-23-5- Standard SMILES
CC(C)(C)OC(=O)N1[C@@H](c2ccccc2)COS1(=O)=O- InChIKey
MRPGVSFPIVVEKD-LLVKDONJSA-N- Molecular formula
- C13H17NO5S
- Average molar mass
- 299.34 g/mol
- Monoisotopic mass
- 299.08274382
Names & identifiers
- Preferred name
- tert-butyl (4S)-2,2-dioxo-4-phenyl-1,2lambda6,3-oxathiazolidine-3-carboxylate
- IUPAC
- tert-butyl (4S)-2,2-dioxo-4-phenyloxathiazolidine-3-carboxylate
- English name
- (4S)-4-Phenyl-1,2,3-oxathiazolidine-2,2-dioxide-3-carboxylic acid t-butyl ester, min. 97%
- Molecular formula
- C13H17NO5S
- Molecular weight
- 299.34
Names & synonyms
479687-23-5RefChem:891907tert-butyl (4S)-2,2-dioxo-4-phenyl-1,2lambda6,3-oxathiazolidine-3-carboxylate109-338-4(4S)-2,2-DIOXIDO-4-PHENYL-1,2,3-OXATHIAZOLIDINE, N-BOC PROTECTEDMFCD17018794(S)-tert-Butyl 4-phenyl-1,2,3-oxathiazolidine-3-carboxylate 2,2-dioxidetert-Butyl (S)-4-phenyl-1,2,3-oxathiazolidine-3-carboxylate 2,2-dioxide(4S)-4-Phenyl-1,2,3-oxathiazolidine-2,2-dioxide-3-carboxylic acid t-butyl ester(S)-3-Boc-4-phenyl-1,2,3-oxathiazolidine 2,2-dioxidetert-butyl (4S)-2,2-dioxo-4-phenyl-1,2,3-oxathiazolidine-3-carboxylatetert-butyl (4S)-2,2-dioxo-4-phenyloxathiazolidine-3-carboxylate
Show more names
(4S)-4-PHENYL-1,2,3-OXATHIAZOLIDINE-2,2-DIOXIDE-3-CARBOXYLICACIDT-BUTYLESTER,MIN.97%1,2,3-Oxathiazolidine-3-carboxylic acid, 4-phenyl-, 1,1-dimethylethyl ester, 2,2-dioxide, (4S)-
(4S)-4-Phenyl-1,2,3-oxathiazolidine-2,2-dioxide-3-carboxylic acid t-butyl ester, min. 97%SCHEMBL15281121WLZ4121MRPGVSFPIVVEKD-LLVKDONJSA-NAKOS027338311tert-butyl (4S)-2,2-dioxo-4-phenyl-1,2|E?,3-oxathiazolidine-3-carboxylateAS-51206SY068601
Database identifiers
- CAS
479687-23-5- PubChem CID
- 11243499
- EC Number
- 109-338-4
Properties
Computed structural properties
- XLogP
- 2
- Topological polar surface area
- 81.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 3
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 456
Physicochemical properties
- storage temp.
- -20 °C · Storage temp. -20°C
- form
- solid
- color
- white
- Sensitive
- air sensitive, store cold
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 261 · P261-P280-P301+P312-P302+P352-P305+P351+P338
- HS Code
- 2934100090 · 2934100090
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
Warning
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesAcute Tox. 4 (100%)
Safety data
- hs_code
- 2934100090
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P261-P280-P301+P312-P302+P352-P305+P351+P338
Related reactions
1 records
Compound notes
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