1-Nonyn-3-ol
Basic information
- CAS
7383-20-2- Standard SMILES
C#CC(O)CCCCCC- InChIKey
XVJKCRIRKNGKPN-UHFFFAOYSA-N- Molecular formula
- C9H16O
- Average molar mass
- 140.22 g/mol
- Monoisotopic mass
- 140.12011513
Names & identifiers
- Preferred name
- 1-Nonyn-3-ol
- IUPAC
- non-1-yn-3-ol
Names & synonyms
7383-20-21-NONYN-3-OLRefChem:1056116non-1-yn-3-olBRN 1745669Hexylpropargylalkohol4-01-00-02265 (Beilstein Handbook Reference)SCHEMBL1888013DTXSID70994947AKOS014245519H53716
Database identifiers
- CAS
7383-20-2- PubChem CID
- 23852
- DTXSID
DTXSID70994947- Nikkaji
- J1.645.014F
Properties
Computed structural properties
- XLogP
- 2.6
- Topological polar surface area
- 20.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 5
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 109
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Compound notes
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