Basic information
- CAS
2845-61-6- Standard SMILES
CC(C)(C)c1cccc(C(C)(C)C)c1OC(=O)NS(=O)(=O)c1ccccc1- InChIKey
NWUOXUCNYVCULB-UHFFFAOYSA-N- Molecular formula
- C21H27NO4S
- Average molar mass
- 389.5 g/mol
- Monoisotopic mass
- 389.16607952
Names & identifiers
- Preferred name
- (2,6-ditert-butylphenyl) N-(benzenesulfonyl)carbamate
- IUPAC
- (2,6-ditert-butylphenyl) N-(benzenesulfonyl)carbamate
Names & synonyms
2845-61-6NSC144063DTXSID90951097NSC-1440632,6-Di-tert-butylphenyl hydrogen (benzenesulfonyl)carbonimidate
Database identifiers
- CAS
2845-61-6- PubChem CID
- 286207
- DTXSID
DTXSID90951097
Properties
Computed structural properties
- XLogP
- 6
- Topological polar surface area
- 80.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 6
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 582
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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