1,3-Cyclohexanediol
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1,3-Cyclohexanediol
structure -
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CAS No:
504-01-8
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Formula:
C6H12O2
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Chemical Name:
1,3-Cyclohexanediol
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Synonyms:
1,3-Cyclohexanediol;Resorcitol;1,3-Benzenediol,hexahydro-;1,3-Dihydroxycyclohexane;NSC 30235
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CAS No:
Characteristics
40.5
0.2
1.0951 g/cm3 @ Temp: 25 °C
45 °C
138-141 °C @ Press: 11 Torr
>230 °F
1.495-1.497
Soluble in water.
Safety Information
NONH for all modes of transport
3
36/37
S24/25
Xi
P261-P305 + P351 + P338
H319-H335
Computed Properties
Molecular Weight:116.16
XLogP3:0.2
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:2
Exact Mass:116.083729621
Monoisotopic Mass:116.083729621
Topological Polar Surface Area:40.5
Heavy Atom Count:8
Complexity:64.9
Undefined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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