Phenol, 2-butyl-6-propyl-
Basic information
- CAS
22496-46-4- Standard SMILES
CCCCc1cccc(CCC)c1O- InChIKey
DOISHLXLWZJLHG-UHFFFAOYSA-N- Molecular formula
- C13H20O
- Average molar mass
- 192.3 g/mol
- Monoisotopic mass
- 192.15141526
Names & identifiers
- Preferred name
- Phenol, 2-butyl-6-propyl-
- IUPAC
- 2-butyl-6-propylphenol
Names & synonyms
2-Butyl-6-propylphenolPhenol, 2-butyl-6-propyl-BRN 304818322496-46-4DTXSID90177018RefChem:369021DTXCID7099509CHEMBL29795SCHEMBL1024684
Database identifiers
- CAS
22496-46-4- PubChem CID
- 211161
- DTXSID
DTXSID90177018- ChEMBL
CHEMBL29795- Nikkaji
- J79.091E
Properties
Computed structural properties
- XLogP
- 4.7
- Topological polar surface area
- 20.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 5
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 144
Suppliers
Loading…
Open inquiries
Loading…
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…