10-bromodec-1-ene

• ChemBase ID: 144626
• Molecular Formular: C10H19Br
• Molecular Mass: 219.16186
• Monoisotopic Mass: 218.06701261
• SMILES: C=CCCCCCCCCBr
• Canonical SMILES: BrCCCCCCCCC=C
• InChI: InChI=1S/C10H19Br/c1-2-3-4-5-6-7-8-9-10-11/h2H,1,3-10H2
• InChIKey: JVVPJOMYWVYPOF-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: 10-bromodec-1-ene
• IUPAC Traditional name: 10-bromodec-1-ene
• Synonyms: 10-Bromo-1-decene; 10-Bromo-1-decene; 10-溴-1-癸烯

Database IDs

• CAS Number: 62871-09-4
• MDL Number: MFCD00078660
• PubChem SID: 24879896; 162238838
• PubChem CID: 543384

CALCULATED PROPERTIES

• H Acceptors: 0
• H Donor: 0
• LogD (pH = 5.5): 4.708833
• LogD (pH = 7.4): 4.708833
• Log P: 4.708833
• Molar Refractivity: 55.8195 cm^3
• Polarizability: 21.496954 Å^3
• Polar Surface Area: 0.0 Å^2
• Rotatable Bonds: 8
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Boiling Point: 50 °C/0.3 mmHg(lit.)
• Flash Point: 204.8 °F; 96 °C
• Density: 1.092 g/mL at 25 °C(lit.)
• Refractive Index: n20/D 1.4660(lit.)

Safety Information

• European Hazard Symbols: Irritant (Xi)
• German water hazard class: 3
• Risk Statements: 36/37/38
• Safety Statements: 26-36
• GHS Pictograms: GHS07
• GHS Signal Word: Warning
• GHS Hazard statements: H315-H319-H335
• GHS Precautionary statements: P261-P305 + P351 + P338
• Personal Protective Equipment: Eyeshields, full-face respirator (US), Gloves, multi-purpose combination respirator cartridge (US), type ABEK (EN14387) respirator filter

Product Information

• Purity: 95+%; 97%
• Linear Formula: Br(CH2)8CH=CH2

DETAILS

Sigma Aldrich - 560855

Packaging
1, 5 g in glass bottle