Tert-butyl 3-[(4-chlorophenyl)sulfinyl]propylcarbamate
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Basic information
- Standard SMILES
CC(C)(C)OC(=O)NCCCS(=O)c1ccc(Cl)cc1- InChIKey
TXJHEGYSBVPOMF-UHFFFAOYSA-N- Molecular formula
- C14H20ClNO3S
- Average molar mass
- 317.8 g/mol
- Monoisotopic mass
- 317.0852424
Names & identifiers
- Preferred name
- Tert-butyl 3-[(4-chlorophenyl)sulfinyl]propylcarbamate
- IUPAC
- tert-butyl N-[3-(4-chlorophenyl)sulfinylpropyl]carbamate
Names & synonyms
TXJHEGYSBVPOMF-UHFFFAOYSA-Ntert-butyl 3-[(4-chlorophenyl)sulfinyl]propylcarbamate
Database identifiers
- PubChem CID
- 91057009
Properties
Computed structural propertiesFilling in
- XLogP
- 2.7
- Topological polar surface area
- 74.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 7
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 336
Related reactions
2 records
Compound notes
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