Basic information
- CAS
101492-91-5- Standard SMILES
O=CCCCCCOCc1ccccc1- InChIKey
OKBHPVOFRDHZPQ-UHFFFAOYSA-N- Molecular formula
- C13H18O2
- Average molar mass
- 206.28 g/mol
- Monoisotopic mass
- 206.13067981
Names & identifiers
- Preferred name
- 6-Benzyloxyhexanal
- IUPAC
- 6-phenylmethoxyhexanal
- English name
- 6-Benzyloxy-hexanal
- Molecular formula
- C13H18O2
- Molecular weight
- 206.28
Names & synonyms
6-benzyloxyhexanal101492-91-5DTXSID80327787RefChem:307276DTXCID502788986-(Benzyloxy)hexanal6-phenylmethoxyhexanal6-BENZYLOXY-HEXANALHexanal, 6-(phenylmethoxy)-MFCD09032481NSC6865056-benzyloxy-1-hexanal
Show more names
6-benzyloxyhexan-1-alSCHEMBL711369CHEMBL1964877OKBHPVOFRDHZPQ-UHFFFAOYSA-NAKOS015965613NSC-686505NCI60_031195DB-317963
Database identifiers
- CAS
101492-91-5- PubChem CID
- 389877
- DTXSID
DTXSID80327787- ChEMBL
CHEMBL1964877- Nikkaji
- J1.227.604D
Properties
Computed structural properties
- XLogP
- 2.1
- Topological polar surface area
- 26.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 8
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 151
Chemistry & industry
Upstream & downstream products
Upstream raw materials
Suppliers2 total
上海鹏鹊化学科技有限公司15317013857 15901926503 · [email protected]
常州宣叶科技有限公司15195022192 · [email protected]
Related reactions
7 records
Compound notes
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