1,5-Hexadiene-3,4-diol
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1,5-Hexadiene-3,4-diol
structure -
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CAS No:
1069-23-4
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Formula:
C6H10O2
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Chemical Name:
1,5-Hexadiene-3,4-diol
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Synonyms:
1,5-Hexadiene-3,4-diol;3,4-Dihydroxy-1,5-hexadiene;Divinylglycol;NSC 60695;1,2-Divinylethylene glycol
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CAS No:
Characteristics
40.46000
-0.02
Light yellow oily liquid
1.006 g/cm3 @ Temp: 20 °C
106 °C
138-144 °C
199 °F
n 20/D 1.479(lit.)
Store in a tightly closed container. Store in a cool, dry, well-ventilated area away from incompatible substances. Store protected from light.
0.0737mmHg at 25°C
Safety Information
III
6.1(b)
UN 2810 6.1/PG 3
3
R23/24/25
26-28-36/37/39-45
MM2100000
T
Stable at room temperature in closed containers under normal storage and handling conditions.
P261-P280-P301 + P310-P311
H301 + H311 + H331
|Danger|H301 (95%): Toxic if swallowed [Danger Acute toxicity, oral]|P261, P264, P270, P271, P280, P301+P310, P302+P352, P304+P340, P311, P312, P321, P322, P330, P361, P363, P403+P233, P405, and P501|Aggregated GHS information provided by 40 companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Computed Properties
Molecular Weight:114.14
XLogP3:0.2
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:3
Exact Mass:114.068079557
Monoisotopic Mass:114.068079557
Topological Polar Surface Area:40.5
Heavy Atom Count:8
Complexity:76.5
Undefined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
