Welcome to LookChem.com Sign In|Join Free
  • or
Home > Products >  > 

1,5-Hexadiene-3,4-diol

Related Products

Hot Products

Name

1,5-Hexadiene-3,4-diol

EINECS 213-955-5
CAS No. 1069-23-4 Density 1.005 g/cm3
PSA 40.46000 LogP 0.08020
Solubility N/A Melting Point 14-16 °C(lit.)
Formula C6H10O2 Boiling Point 201.9 °C at 760 mmHg
Molecular Weight 114.144 Flash Point 92.8 °C
Transport Information UN 2810 6.1/PG 3 Appearance Light yellow oily liquid
Safety 26-28-36/37/39-45 Risk Codes 23/24/25
Molecular Structure Molecular Structure of 1069-23-4 (1,5-Hexadiene-3,4-diol) Hazard Symbols ToxicT
Synonyms

Diethylene glycol divinyl;

Article Data 41

1,5-Hexadiene-3,4-diol Specification

The Hexa-1,5-diene-3,4-diol, with the CAS registry number 1069-23-4 and EINECS registry number 213-955-5, has the systematic name and IUPAC name of hexa-1,5-diene-3,4-diol. It belongs to the following product categories: Pharmaceutical Intermediates; Alcohols; Monomers; Polymer Science. And the molecular formula of the chemical is C6H10O2.

The physical properties of Hexa-1,5-diene-3,4-diol are as followings: (1)ACD/LogP: -0.02; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -0.02; (4)ACD/LogD (pH 7.4): -0.02; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 23.23; (8)ACD/KOC (pH 7.4): 23.23; (9)#H bond acceptors: 2; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 5; (12)Polar Surface Area: 18.46 Å2; (13)Index of Refraction: 1.48; (14)Molar Refractivity: 32.28 cm3; (15)Molar Volume: 113.5 cm3; (16)Polarizability: 12.79×10-24cm3; (17)Surface Tension: 35.4 dyne/cm; (18)Density: 1.005 g/cm3; (19)Flash Point: 92.8 °C; (20)Enthalpy of Vaporization: 50.97 kJ/mol; (21)Boiling Point: 201.9 °C at 760 mmHg; (22)Vapour Pressure: 0.0737 mmHg at 25°C.

Uses of Hexa-1,5-diene-3,4-diol: It can react with 2,2-dimethoxy-propane to produce 2,2-dimethyl-4,5-divinyl-[1,3]dioxolane. This reaction will need reagent p-TsOH-H2O, and the menstruum CH2Cl2. The reaction time is 8 hours with temperature of 20°C, and the yield is about 88%.

You should be cautious while dealing with this chemical. It is toxic by inhalation, in contact with skin and if swallowed. Therefore, you had better take the following instructions: Wear suitable protective clothing, gloves and eye/face protection, and in case of contacting with eyes, rinse immediately with plenty of water and seek medical advice; After contact with skin, wash immediately with plenty of ... (to be specified by the manufacturer); In case of accident or if you feel unwell, seek medical advice immediately (show label where possible).

You can still convert the following datas into molecular structure:
(1)SMILES: OC(\C=C)C(O)\C=C
(2)InChI: InChI=1/C6H10O2/c1-3-5(7)6(8)4-2/h3-8H,1-2H2
(3)InChIKey: KUQWZSZYIQGTHT-UHFFFAOYAM

The toxicity data is as follows:

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
rabbit LD50 skin 400uL/kg (0.4mL/kg)   American Industrial Hygiene Association Journal. Vol. 30, Pg. 470, 1969.
rat LD50 oral 1620uL/kg (1.62mL/kg)   American Industrial Hygiene Association Journal. Vol. 30, Pg. 470, 1969.

Post a RFQ

Enter 15 to 2000 letters.Word count: 0 letters

Attach files(File Format: Jpeg, Jpg, Gif, Png, PDF, PPT, Zip, Rar,Word or Excel Maximum File Size: 3MB)

1

What can I do for you?
Get Best Price

Get Best Price for 1069-23-4