Nona-1,3-diene
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Basic information
- CAS
56700-77-7- Standard SMILES
C=C/C=C/CCCCC- InChIKey
CLNYHERYALISIR-FNORWQNLSA-N- Molecular formula
- C9H16
- Average molar mass
- 124.22 g/mol
- Monoisotopic mass
- 124.12520051
Overview
CLNYHERYALISIR-FNORWQNLSA-N has been reported in Petasites hybridus with data available.
Names & identifiers
- Preferred name
- Nona-1,3-diene
- IUPAC
- (3E)-nona-1,3-diene
- English name
- (E)-1,3-Nonadiene
- Molecular formula
- C9H16
- Molecular weight
- 124.22
Names & synonyms
nona-1,3-dieneDTXSID20102015071030-52-9RefChem:1092492DTXCID6014779971,3-Nonadiene, (E)-(E)-1,3-Nonadiene1,3-NonadieneNonadiene56700-77-7(E)-n-C5H11CH=CHCH=CH21,cis-3-nonadiene
Show more names
1,3-Nonadiene, (3E)-
(3E)-nona-1,3-diene(3E)-1,3-Nonadiene1,trans-3-Nonadienetrans-1,3-NonadieneSCHEMBL151477SCHEMBL236771SCHEMBL1677872SCHEMBL5726557
Database identifiers
- CAS
56700-77-7、71030-52-9- PubChem CID
- 5352755
- DTXSID
DTXSID201020150- Nikkaji
- J128.978K、J2.360.085D
Properties
Computed structural propertiesFilling in
- XLogP
- 4.1
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 0
- Rotatable bonds
- 5
- Heavy atoms
- 9
- Formal charge
- 0
- Complexity
- 80
Physicochemical properties
- Boiling point
- 150 · 150-154 °C
- Density
- 0.749 · 0.749±0.06 g/cm3(Predicted)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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