Basic information
- CAS
13360-61-7- Standard SMILES
C=CCCCCCCCCCCCCC- InChIKey
PJLHTVIBELQURV-UHFFFAOYSA-N- Molecular formula
- C15H30
- Average molar mass
- 210.4 g/mol
- Monoisotopic mass
- 210.23475096
Overview
1-pentadecene is an unbranched fifteen-carbon alkene with one double bond between C-1 and C-2. It has a role as a mammalian metabolite.
Names & identifiers
- Preferred name
- 1-Pentadecene
- IUPAC
- pentadec-1-ene
- English name
- 1-Pentadecene
- Molecular formula
- C15H30
- Molecular weight
- 210.4
Names & synonyms
Show more names
Database identifiers
- CAS
13360-61-7、27251-68-9- PubChem CID
- 25913
- DTXSID
DTXSID1065421- ChEBI
CHEBI:77506- UNII
- KH577LIA74
- EC Number
- 236-414-5、248-364-1
- Nikkaji
- J638F
Properties
Computed structural properties
- XLogP
- 8.4
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 0
- Rotatable bonds
- 12
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 115
Experimental & physicochemical properties
Physical Description
Liquid; [Aldrich MSDS]
Liquid
Physicochemical properties
- Melting point
- 4 °C · −4 °C(lit.)
- Boiling point
- 268 · 268-269 °C(lit.)
- Density
- 0.775 g/mL · 0.775 g/mL at 25 °C(lit.)
- refractive index
- 20 · n20/D 1.439(lit.)
- Flash point
- 230 °F · >230 °F
- storage temp.
- Sealed in dry,Room Temperature
- form
- clear liquid
- color
- Colorless
- Specific Gravity
- 0.775 · 0.775
- Water Solubility
- Not miscible or difficult to mix in water.
- BRN
- 1751011 · 1751011
- Henry's Law Constant
- 2.2 · 2.2×10-6 mol/(m3Pa) at 25℃, Brockbank (2013)
- InChI
- 1S/C15H30/c1-3-5-7-9-11-13-15-14-12-10-8-6-4-2/h3H,1,4-15H2,2H3
- InChIKey
- PJLHTVIBELQURV-UHFFFAOYSA-N
- SMILES
- CCCCCCCCCCCCCC=C
- CAS DataBase Reference
- 13360 · 13360-61-7(CAS DataBase Reference)
- EWG's Food Scores
- 1 · 1
- FDA UNII
- 577 LIA74 · KH577LIA74
- EPA Substance Registry System
- 1 · 1-Pentadecene (13360-61-7)
- UNSPSC Code
- 12352100 · 12352100
- NACRES
- 22 · NA.22
- Symbol(GHS)
- 8 · GHS08
- Signal word
- Danger
- Hazard statements
- 304 · H304
- Precautionary statements
- 301 · P301+P310+P331-P405-P501
- PPE
- Eyeshields, Gloves, multi-purpose combination respirator cartridge (US)
- Safety Statements
- 23 · 23-24/25
- WGK Germany
- 3 · 3
- TSCA
- TSCA listed
- HS Code
- 2901.29 · 2901.29.1050
- Storage Class
- 10 · 10 - Combustible liquids
Safety & regulation
GHS classification
GHS Classification
This chemical does not meet GHS hazard criteria for 50% (3 of 6) of reports.
Danger
H304 (33.3%): May be fatal if swallowed and enters airways [Danger Aspiration hazard]
P261, P264, P264+P265, P271, P280, P301+P316, P302+P352, P304+P340, P305+P351+P338, P319, P321, P331, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 6 reports by companies from 4 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Safety data
- PPE
- Eyeshields, Gloves, multi-purpose combination respirator cartridge (US)
- wgk
- 3
- tsca
- TSCA listed
- hs_code
- 2901.29.1050
- Signal word
- Danger
- Symbol(GHS)
- GHS08
- safety_code
- 23-24/25
- Storage Class
- 10 - Combustible liquids
- Hazard statements
- H304
- Precautionary statements
- P301+P310+P331-P405-P501
Chemistry & industry
Pharmacology
Uses & manufacturing
General Manufacturing Information
1-Pentadecene: ACTIVE
Pentadecene: ACTIVE
Applications
Uses1-Pentadecene serves as a growth medium for the strain CV2803T. It is a common semiochemical of flour beetles.
Upstream & downstream products
Downstream products
Suppliers74 total
Additional notes
DefinitionChEBI: An unbranched fifteen-carbon alkene with one double bond between C-1 and C-2.
Related reactions
Compound notes
Loading…