Basic information
- CAS
6331-90-4- Standard SMILES
CCCCCCCCCCCCOC(=O)NC1c2ccccc2Oc2c(C)cccc21- InChIKey
WZZBNRSEILLNFN-UHFFFAOYSA-N- Molecular formula
- C27H37NO3
- Average molar mass
- 423.6 g/mol
- Monoisotopic mass
- 423.27734404
Names & identifiers
- Preferred name
- dodecyl N-(4-methyl-9H-xanthen-9-yl)carbamate
- IUPAC
- dodecyl N-(4-methyl-9H-xanthen-9-yl)carbamate
Names & synonyms
NSC37360NSC-373606331-90-4
Database identifiers
- CAS
6331-90-4- PubChem CID
- 235697
Properties
Computed structural properties
- XLogP
- 8.7
- Topological polar surface area
- 47.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 13
- Heavy atoms
- 31
- Formal charge
- 0
- Complexity
- 511
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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