Basic information
- CAS
69188-47-2- Standard SMILES
CCCCCCCCC=CCCCCCCCCCCCCCCC- InChIKey
YJTCMKZGFBOKQS-UHFFFAOYSA-N- Molecular formula
- C25H50
- Average molar mass
- 350.7 g/mol
- Monoisotopic mass
- 350.3912516
Overview
9-pentacosene has been reported in Antitrogus consanguineus, Reticulitermes flavipes, and Pelargonium endlicherianum with data available.
Names & identifiers
- Preferred name
- Pentacos-9-ene
- IUPAC
- pentacos-9-ene
- English name
- (Z)-9-Pentacosene
- Molecular formula
- C25H50
- Molecular weight
- 350.67
Names & synonyms
PENTACOS-9-ENESCHEMBL4212224SCHEMBL5985745YJTCMKZGFBOKQS-UHFFFAOYSA-NPD0884799Z-25(Z)-9-Pentacosene
Database identifiers
- CAS
69188-47-2- PubChem CID
- 25201650
- DTXSID
DTXSID80897091
Properties
Computed structural properties
- XLogP
- 12.8
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 0
- Rotatable bonds
- 21
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 240
Physicochemical properties
- Boiling point
- 427.754 · 427.754±12.00 °C(Press: 760.00 Torr)(predicted)
- Density
- 0.806 · 0.806±0.06 g/cm3(Temp: 25 °C; Press: 760 Torr)(predicted)
- FDA UNII
- 7 R5C51EW · IF7R5C51EW
- EPA Substance Registry System
- 9 · 9-Pentacosene (69188-47-2)
Chemistry & industry
Suppliers7 total
湖北科乐精细化工有限公司027-59101668 19945030958 · [email protected]
上海皓之翔生物科技有限公司（原上海拓青化工有限公司）526763801 13301653310 · [email protected]
河南伊诺凯新材料有限公司15764055027 15764055027 · [email protected]
深圳市丽晶生化科技有限公司0755-85201366 18938635012 · [email protected]
武汉爱默尔特科技有限公司027-888-4366503 13986279625 · [email protected]
河南伊诺凯新材料有限公司15090072163 · [email protected]
郑州灵之悦科技有限公司+86-0371-55074660 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…