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Basic information
- Standard SMILES
CC(C)(C)OC(=O)NC1(C(C=O)c2ccc(Cl)cc2)CC1- InChIKey
LHQAMQHYZUNEPL-UHFFFAOYSA-N- Molecular formula
- C16H20ClNO3
- Average molar mass
- 309.79 g/mol
- Monoisotopic mass
- 309.1131712
Names & identifiers
- Preferred name
- tert-Butyl 1-(1-(4-chlorophenyl)-2-oxoethyl)cyclopropylcarbamate
- IUPAC
- tert-butyl N-[1-[1-(4-chlorophenyl)-2-oxoethyl]cyclopropyl]carbamate
Names & synonyms
SCHEMBL2578017LHQAMQHYZUNEPL-UHFFFAOYSA-Ntert-Butyl 1-(1-(4-chlorophenyl)-2-oxoethyl)cyclopropylcarbamate
Database identifiers
- PubChem CID
- 86675331
Properties
Computed structural propertiesFilling in
- XLogP
- 3.6
- Topological polar surface area
- 55.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 6
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 393
Related reactions
1 records
Compound notes
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