non-1-ene

• ChemBase ID: 73709
• Molecular Formular: C9H18
• Molecular Mass: 126.23922
• Monoisotopic Mass: 126.14085058
• SMILES: C=CCCCCCCC
• Canonical SMILES: CCCCCCCC=C
• InChI: InChI=1S/C9H18/c1-3-5-7-9-8-6-4-2/h3H,1,4-9H2,2H3
• InChIKey: JRZJOMJEPLMPRA-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: non-1-ene
• IUPAC Traditional name: nonene
• Synonyms: 1-Nonene; Non-1-ene; alpha-Nonene; Nonene; 1-壬烯

Database IDs

• CAS Number: 124-11-8
• EC Number: 204-681-7
• MDL Number: MFCD00009568
• Beilstein Number: 1698439
• PubChem SID: 24897620; 24886682; 162038628
• PubChem CID: 31285
• Chemspider ID: 29025
• Wikipedia Title: Nonene

CALCULATED PROPERTIES

• H Acceptors: 0
• H Donor: 0
• LogD (pH = 5.5): 4.160856
• LogD (pH = 7.4): 4.160856
• Log P: 4.160856
• Molar Refractivity: 43.2553 cm^3
• Polarizability: 17.142464 Å^3
• Polar Surface Area: 0.0 Å^2
• Rotatable Bonds: 6
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Melting Point: -81 °C(lit.)
• Boiling Point: 146 °C(lit.)
• Flash Point: 24 °C; 75.2 °F
• Density: 0.73 g/mL at 25 °C(lit.)
• Refractive Index: n20/D 1.416; n20/D 1.416(lit.)
• Vapor Pressure: 11 mmHg ( 37.7 °C)
• Vapor Density: 4.35 (vs air)

Safety Information

• Storage Warning: Flammable
• European Hazard Symbols: Harmful (Xn)
• UN Number: 3295
• German water hazard class: 3
• Hazard Class: 3
• Packing Group: 3
• Risk Statements: 10-36/37/38-65
• Safety Statements: 26-36-62
• GHS Pictograms: GHS02; GHS07; GHS08
• GHS Signal Word: Danger
• GHS Hazard statements: H226-H304-H315-H319-H335
• GHS Precautionary statements: P261-P301 + P310-P305 + P351 + P338-P331
• Personal Protective Equipment: Eyeshields, Faceshields, full-face respirator (US), Gloves, multi-purpose combination respirator cartridge (US), type ABEK (EN14387) respirator filter
• RID/ADR: UN 3295 3/PG 3

Product Information

• Purity: ≥95.0% (GC); ≥99.5% (GC); 96%
• Grade: analytical standard; purum
• Shelf Life: (limited shelf life, expiry date on the label)
• Linear Formula: CH3(CH2)6CH=CH2

DETAILS

Sigma Aldrich - N30404

Packaging
2, 5, 25 g in glass bottle