Basic information
- CAS
18441-56-0- Standard SMILES
CCCc1ccc(O)c(C)c1- InChIKey
LDQYTDPXIMNESL-UHFFFAOYSA-N- Molecular formula
- C10H14O
- Average molar mass
- 150.22 g/mol
- Monoisotopic mass
- 150.10446507
Names & identifiers
- Preferred name
- 2-Methyl-4-propylphenol
- IUPAC
- 2-methyl-4-propylphenol
- English name
- 4-propyl-o-cresol
- Molecular formula
- C10H14O
- Molecular weight
- 150.22
Names & synonyms
2-Methyl-4-propylphenol4-Propyl-o-cresol18441-56-0HQW38XP2JLDTXSID50171572RefChem:1063743DTXCID6094063242-320-5Phenol, 2-methyl-4-propyl-2-methyl-4-propyl-phenolo-Cresol, 4-propyl-EINECS 242-320-5
Show more names
SCHEMBL332894SCHEMBL7750889NS00026053
Database identifiers
- CAS
18441-56-0- PubChem CID
- 87643
- DTXSID
DTXSID50171572- UNII
- HQW38XP2JL
- EC Number
- 242-320-5
- Nikkaji
- J266.177B
Properties
Computed structural properties
- XLogP
- 3.3
- Topological polar surface area
- 20.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 2
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 111
Physicochemical properties
- Melting point
- 43 °C · 43°C
- Boiling point
- 240 °C · 240°C
- Density
- 0.9688 · 0.9688 (estimate)
- refractive index
- 1.5104 · 1.5104 (estimate)
- FDA UNII
- 38 XP2JL · HQW38XP2JL
Chemistry & industry
Suppliers3 total
上海创焰化学科技有限公司021-11111111 11111111111 · [email protected]
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]
珠海奥博凯生物医药技术有限公司400-0628126 · [email protected]
Related reactions
4 records
Compound notes
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