(4Z)-dec-4-en-1-ol

• ChemBase ID: 142416
• Molecular Formular: C10H20O
• Molecular Mass: 156.2652
• Monoisotopic Mass: 156.15141526
• SMILES: CCCCC/C=C\CCCO
• Canonical SMILES: CCCCC/C=C\CCCO
• InChI: InChI=1S/C10H20O/c1-2-3-4-5-6-7-8-9-10-11/h6-7,11H,2-5,8-10H2,1H3/b7-6-
• InChIKey: VUNFOJWKJSYIDH-SREVYHEPSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: (4Z)-dec-4-en-1-ol
• IUPAC Traditional name: (4Z)-dec-4-en-1-ol
• Synonyms: cis-4-Decen-1-ol; 顺-4-癸烯-1-醇

Database IDs

• CAS Number: 57074-37-0
• EC Number: 260-548-3
• MDL Number: MFCD00015568
• Beilstein Number: 4174377
• PubChem SID: 24878753; 162236646
• PubChem CID: 5362798
• FEMA ID: 4349

CALCULATED PROPERTIES

• Acid pKa: 16.961275
• H Acceptors: 1
• H Donor: 1
• LogD (pH = 5.5): 3.1108122
• LogD (pH = 7.4): 3.1108122
• Log P: 3.1108122
• Molar Refractivity: 50.8575 cm^3
• Polarizability: 19.548393 Å^3
• Polar Surface Area: 20.23 Å^2
• Rotatable Bonds: 7
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Boiling Point: 231-232 °C(lit.); 231-232°C
• Flash Point: >110 °C; >230 °F; 105°C(221°F)
• Density: 0.850; 0.853 g/mL at 25 °C(lit.)
• Refractive Index: 1.4500; n20/D 1.452(lit.)

Safety Information

• European Hazard Symbols: Irritant (Xi)
• German water hazard class: 3
• Risk Statements: 36/37/38
• Safety Statements: 26-36
• TSCA Listed: 是
• 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: 97%
• Linear Formula: CH3(CH2)4CH=CH(CH2)3OH

DETAILS

Sigma Aldrich - W434900

Packaging
1 kg in poly bottle
1 sample in glass bottle
100 g in poly bottle

Sigma Aldrich - 547107

Packaging
25 g in glass bottle