dec-1-ene

• ChemBase ID: 73711
• Molecular Formular: C10H20
• Molecular Mass: 140.2658
• Monoisotopic Mass: 140.15650064
• SMILES: C=CCCCCCCCC
• Canonical SMILES: CCCCCCCCC=C
• InChI: InChI=1S/C10H20/c1-3-5-7-9-10-8-6-4-2/h3H,1,4-10H2,2H3
• InChIKey: AFFLGGQVNFXPEV-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: dec-1-ene
• IUPAC Traditional name: decene
• Synonyms: 1-DECENE; Decene; 1-Decene; Dec-1-ene; 1-癸烯

Database IDs

• CAS Number: 872-05-9
• EC Number: 212-819-2
• MDL Number: MFCD00009577
• Beilstein Number: 1737236
• PubChem SID: 24858339; 162038630; 24858341; 24858343; 24867764; 24893549
• PubChem CID: 13381
• Chemspider ID: 12809
• Unique Ingredient Identifier: 7O4U4C718P
• Wikipedia Title: Decene

CALCULATED PROPERTIES

• H Acceptors: 0
• H Donor: 0
• LogD (pH = 5.5): 4.6054244
• LogD (pH = 7.4): 4.6054244
• Log P: 4.6054244
• Molar Refractivity: 47.8563 cm^3
• Polarizability: 18.989107 Å^3
• Polar Surface Area: 0.0 Å^2
• Rotatable Bonds: 7
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Apperance: Colorless liquid
• Melting Point: -66.3°C; -66.3--66 °C(lit.); -66°C
• Boiling Point: 166.5-173.5 °C(lit.); 170-171°C; 170-171°C; 172°C
• Flash Point: 111.2 °F; 44 °C; 49°C(120°F)
• Auto Ignition Point: 455 °F
• Density: 0.74 g/cm^3; 0.741; 0.741 g/ml; 0.741 g/mL at 25 °C(lit.)
• Refractive Index: 1.4210; n20/D 1.421; n20/D 1.421(lit.)
• Vapor Pressure: 1.6 mmHg ( 23.8 °C)
• Vapor Density: 4.84 (vs air)

Safety Information

• Storage Warning: Flammable
• RTECS: HE2071401
• European Hazard Symbols: Flammable (F); Nature polluting (N); X; Irritant (Xi); Harmful (Xn)
• UN Number: 3295; UN3295
• German water hazard class: 1
• Hazard Class: 3
• Packing Group: 3; III
• Risk Statements: 10-38-53-65; 10-38-65; 10-50/53-65-66; R:10
• Safety Statements: 36/37-60-62; 60-61-62; 62; S:9-16-29
• TSCA Listed: 是
• GHS Pictograms: GHS02; GHS07; GHS08; GHS09
• GHS Signal Word: Danger
• GHS Hazard statements: H226-H304-H315; H226-H304-H410; H304-H226-H315
• GHS Precautionary statements: P210-P241-P301+P310-P303+P361+P353-P405-P501A; P273-P301 + P310-P331-P501; P301 + P310-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
• Supplemental Hazard Statements: Repeated exposure may cause skin dryness or cracking.

Product Information

• Purity: ~96% (GC); ≥95.0% (GC); ≥97.0% (GC); ≥99.5% (GC); 94%; 96%, remainder isomers
• Grade: analytical standard; purum
• Packaging: ampule of 1000 mg
• Impurities: ≤2.0% 2-butyl-1-hexene; ≤2.0% 2-ethyl-1-octene; ≤2.0% n-decane
• Shelf Life: (limited shelf life, expiry date on the label)
• Linear Formula: CH3(CH2)7CH=CH2

DETAILS

MP Biomedicals - 05202876

MP Biomedicals Rare Chemical collection

Sigma Aldrich - 30650

Packaging
100, 500 mL in glass bottle

Sigma Aldrich - D1807

Packaging
1 L in glass bottle
100 mL in glass bottle