Basic information
- Standard SMILES
CC(C)(C)OC(=O)Nc1cc(C2=CCCC2)ccc1[N+](=O)[O-]- InChIKey
UIFPQNKYXCNLTG-UHFFFAOYSA-N- Molecular formula
- C16H20N2O4
- Average molar mass
- 304.34 g/mol
Names & identifiers
- Preferred name
- Tert-butyl (5-(cyclopent-1-en-1-yl)-2-nitrophenyl)carbamate
- IUPAC
- tert-butyl N-[5-(cyclopenten-1-yl)-2-nitrophenyl]carbamate
Names & synonyms
SCHEMBL13833546SCHEMBL30118379UIFPQNKYXCNLTG-UHFFFAOYSA-Ntert-butyl (5-(cyclopent-1-en-1-yl)-2-nitrophenyl)carbamate
Database identifiers
- PubChem CID
- 71007338
Properties
Computed structural properties
- XLogP
- 4
- Topological polar surface area
- 84.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 462
Related reactions
4 records
Compound notes
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