Basic information
- CAS
67599-20-6- Standard SMILES
CCC(C)COc1ccc(O)cc1- InChIKey
GCQBIYCSSJYFJX-UHFFFAOYSA-N- Molecular formula
- C11H16O2
- Average molar mass
- 180.24 g/mol
- Monoisotopic mass
- 180.11502975
Names & identifiers
- Preferred name
- Phenol, 4-(2-methylbutoxy)-
- IUPAC
- 4-(2-methylbutoxy)phenol
- English name
- 4-(2-Methylbutoxy)benzenol
- Molecular formula
- C11H16O2
- Molecular weight
- 180.24
Names & synonyms
67599-20-6Phenol, 4-(2-methylbutoxy)-4-(2'-Methyl-1'-butoxy)phenolDTXSID20886843RefChem:861217DTXCID6010261624-(2-methylbutoxy)phenol4-(2-methylbutoxy)benzenolMFCD01814872Bionet2_0003624-(2-methylbutyloxy)phenolSCHEMBL8912305
Show more names
HMS1365A10AKOS00508092012N-198
Database identifiers
- CAS
67599-20-6- PubChem CID
- 106720
- DTXSID
DTXSID20886843- Nikkaji
- J453.376C
Properties
Computed structural properties
- XLogP
- 3.2
- Topological polar surface area
- 29.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 4
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 128
Physicochemical properties
- EPA Substance Registry System
- 4 · Phenol, 4-(2-methylbutoxy)- (67599-20-6)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 280 · P280-P305+P351+P338
- TSCA
- TSCA listed
Safety & regulation
Safety data
- tsca
- TSCA listed
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P280-P305+P351+P338
Chemistry & industry
Uses & manufacturing
General Manufacturing InformationPhenol, 4-(2-methylbutoxy)-: INACTIVE
Suppliers4 total
Ryan Scientific, Inc.[email protected]
BIONET-INTER[email protected]
MATRIX[email protected]
ASDI-INTER[email protected]
Related reactions
4 records
Compound notes
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