Basic information
- CAS
53907-72-5- Standard SMILES
C=CCCC(O)CCC- InChIKey
MJWKMORBWQZWOT-UHFFFAOYSA-N- Molecular formula
- C8H16O
- Average molar mass
- 128.21 g/mol
- Monoisotopic mass
- 128.12011513
Overview
Oct-7-en-4-ol has been reported in Glycine max and Cucurbita maxima with data available.
Names & identifiers
- Preferred name
- 7-Octen-4-OL
- IUPAC
- oct-7-en-4-ol
- English name
- 1-Octene-5-ol
- Molecular formula
- C8H16O
- Molecular weight
- 128.21
Names & synonyms
7-OCTEN-4-OLoct-7-en-4-olDTXSID40968695RefChem:106490DTXCID901396265MJWKMORBWQZWOT-UHFFFAOYSA-N53907-72-51-Octene-5-olSCHEMBL2474318SCHEMBL5132625MFCD16091601AKOS011019332
Show more names
7-octene-4-ol
AS-56355DB-312272D93149F844002
Database identifiers
- CAS
53907-72-5- PubChem CID
- 40923
- DTXSID
DTXSID40968695- Nikkaji
- J100.633I
Properties
Computed structural properties
- XLogP
- 2.3
- Topological polar surface area
- 20.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 5
- Heavy atoms
- 9
- Formal charge
- 0
- Complexity
- 69
Physicochemical properties
- Boiling point
- 60 °C · 60 °C(Press: 10 Torr)
- Density
- 0.834 · 0.834±0.06 g/cm3(Predicted)
- pka
- 15.2 · 15.20±0.20(Predicted)
- LogP
- 2.149 · 2.149 (est)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 280 · P280-P305+P351+P338
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P280-P305+P351+P338
Chemistry & industry
Suppliers3 total
BOC Sciences[email protected]
江苏艾康生物医药研发有限公司025-66061636 19370895928 · [email protected]
上海凯为化学科技有限公司021-58461859 15821823057 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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