Basic information
- CAS
775-93-9- Standard SMILES
CCC(C)(CC)c1ccc(O)c(C)c1- InChIKey
YAHLKNBZQFSSCY-UHFFFAOYSA-N- Molecular formula
- C13H20O
- Average molar mass
- 192.3 g/mol
- Monoisotopic mass
- 192.15141526
Names & identifiers
- Preferred name
- 2-METHYL-4-tert-HEXYLPHENOL
- IUPAC
- 2-methyl-4-(3-methylpentan-3-yl)phenol
- English name
- 4-(1-Ethyl-1-methylpropyl)-o-cresol
- Molecular weight
- 0
Names & synonyms
2-METHYL-4-tert-HEXYLPHENOL775-93-9DTXSID30304604RefChem:263460DTXCID602557362-methyl-4-(3-methylpentan-3-yl)phenol4-(1-Ethyl-1-methylpropyl)-o-cresolNSC166450SCHEMBL11319965AKOS006272881NSC-166450DB-218216
Show more names
4-(1-Ethyl-1-methylpropyl)-2-methylphenol4-(1-Ethyl-1-methylpropyl)-2-methylphenol in isooctane
Database identifiers
- CAS
775-93-9- PubChem CID
- 296356
- DTXSID
DTXSID30304604- Nikkaji
- J309.043D
Properties
Computed structural properties
- XLogP
- 4.7
- Topological polar surface area
- 20.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 3
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 172
Chemistry & industry
Suppliers2 total
坛墨质检科技股份有限公司4008-099-669 · [email protected]
上海甄准生物科技有限公司15800340161 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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