1-Butoxy-3-(phenylmethoxy)propan-2-ol
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Basic information
- CAS
86831-83-6- Standard SMILES
CCCCOCC(O)COCc1ccccc1- InChIKey
ZMOVOCVQXFKQEA-UHFFFAOYSA-N- Molecular formula
- C14H22O3
- Average molar mass
- 238.32 g/mol
- Monoisotopic mass
- 238.15689456
Names & identifiers
- Preferred name
- 1-Butoxy-3-(phenylmethoxy)propan-2-ol
- IUPAC
- 1-butoxy-3-phenylmethoxypropan-2-ol
- English name
- 1-butoxy-3-(phenylmethoxy)propan-2-ol
- Molecular formula
- C14H22O3
- Molecular weight
- 238.32
Names & synonyms
1-Butoxy-3-(phenylmethoxy)propan-2-olEINECS 289-284-786831-83-61-Butoxy-3-(phenylmethoxy)-2-propanol1-(BENZYLOXY)-3-BUTOXYPROPAN-2-OLSCHEMBL9662704DTXSID801007138NS000661752-Propanol, 1-butoxy-3-(phenylmethoxy)-
Database identifiers
- CAS
86831-83-6- PubChem CID
- 3021135
- DTXSID
DTXSID801007138- EC Number
- 289-284-7
- Nikkaji
- J333.985H
Properties
Computed structural propertiesFilling in
- XLogP
- 2.1
- Topological polar surface area
- 38.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 9
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 167
Related reactions
4 records
Compound notes
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