1-Propanol, 3-(3-phenoxypropoxy)-, formate
Basic information
- CAS
6290-35-3- Standard SMILES
O=COCCCOCCCOc1ccccc1- InChIKey
KNNIGWIJHNPUMS-UHFFFAOYSA-N- Molecular formula
- C13H18O4
- Average molar mass
- 238.28 g/mol
- Monoisotopic mass
- 238.12050905
Names & identifiers
- Preferred name
- 1-Propanol, 3-(3-phenoxypropoxy)-, formate
- IUPAC
- 3-(3-phenoxypropoxy)propyl formate
- English name
- Formic acid 3-(3-phenoxypropoxy)propyl ester
- Molecular formula
- C13H18O4
- Molecular weight
- 238.28
Names & synonyms
1-Propanol, 3-(3-phenoxypropoxy)-, formate6290-35-3WAG8AZ5ZW3NSC 66353-(3-Phenoxypropoxy)-1-propanol formateNSC-6635UNII-WAG8AZ5ZW3DTXSID402120841-PROPANOL, 3-(3-PHENOXYPROPOXY)-, 1-FORMATERefChem:77154DTXCID401345753-(3-phenoxypropoxy)propyl formate
Show more names
Formic acid 3-(3-phenoxypropoxy)propyl ester
NSC6635WLN: VHO3O3OR
Database identifiers
- CAS
6290-35-3- PubChem CID
- 80506
- DTXSID
DTXSID40212084- UNII
- WAG8AZ5ZW3
- Nikkaji
- J51.005J
Properties
Computed structural properties
- XLogP
- 2.4
- Topological polar surface area
- 44.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 10
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 178
Physicochemical properties
- FDA UNII
- 8 AZ5ZW3 · WAG8AZ5ZW3
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Related reactions
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Compound notes
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