1,3-Cyclohexanediol, mixture of cis and trans
Product Information
Molecular Formula
C6H12O2
Molecular Weight
116.16
Description
1,3-Cyclohexanediol, mixture of cis and trans (CAS# 504-01-8) is a useful research chemical.
Synonyms
cyclohexane-1,3-diol
IUPAC Name
cyclohexane-1,3-diol
SMILES
C1CC(CC(C1)O)O
InChI
InChI=1S/C6H12O2/c7-5-2-1-3-6(8)4-5/h5-8H,1-4H2
InChI Key
RLMGYIOTPQVQJR-UHFFFAOYSA-N
Boiling Point
246-247 °C (lit.)
Melting Point
30 °C
Flash Point
>230 °F
Purity
> 98.0 % (GC)
Density
0.9958 (rou gh estimate)
Appearance
White to almost white powder to crystal
Refractive Index
1.495-1.497
LogP
0.28220
Safety Information
Hazards
H319 - H335
Precautionary Statement
P305 + P351 + P338
Signal Word
Warning
Computed Properties
XLogP3
0.2
Hydrogen Bond Donor Count
2
Hydrogen Bond Acceptor Count
2
Rotatable Bond Count
0
Exact Mass
116.083729621 g/mol
Monoisotopic Mass
116.083729621 g/mol
Topological Polar Surface Area
40.5Ų
Heavy Atom Count
8
Formal Charge
0
Complexity
64.9
Isotope Atom Count
0
Defined Atom Stereocenter Count
0
Undefined Atom Stereocenter Count
2
Defined Bond Stereocenter Count
0
Undefined Bond Stereocenter Count
0
Covalently-Bonded Unit Count
1
Compound Is Canonicalized
Yes
Patents
| Publication Number | Title | Priority Date |
|---|---|---|
| CN-114058003-A | Double metal cyanide catalyst convenient to separate and preparation method thereof | 2021-12-06 |
| CN-114085370-A | Poly (carbonate-ether) polyol dispersant, high-stability polymer polyol and preparation method thereof | 2021-12-06 |
| CN-113980252-A | Continuous production method of modified poly (butylene succinate) | 2021-11-19 |
| CN-113845775-A | Preparation method of hyperbranched polymer modified boron nitride heat-conducting and insulating composite material | 2021-11-08 |
| CN-113980259-A | Method for preparing polycarbonate by using 1,1,3,3,4,4,6, 6-octamethyltetrahydropentene-2, 5-diol | 2021-10-14 |
| CN-113480722-A | Polycarbonate and preparation method and application thereof | 2021-08-06 |
| CN-113444425-A | Water-based epoxy fireproof coating and preparation method and application thereof | 2021-07-29 |
| CN-113354863-A | Degradation method of waste polyurethane and polyurethane thermal insulation material | 2021-07-08 |
| CN-113429540-A | Method for preparing polyurethane thermal insulation material by degrading waste polyurethane with polyol alcoholysis agent | 2021-07-08 |
| CN-113278190-A | Preparation method of graphene/waste polyurethane composite material | 2021-07-08 |
Literatures
| PMID | Publication Date | Title | Journal |
|---|---|---|---|
| 22579521 | 2012-10-01 | Thermal expansion of the cryoprotectant cocktail DP6 combined with synthetic ice modulators in presence and absence of biological tissues | Cryobiology |
| 22259513 | 2012-01-01 | 3-Cyclo-propyl-1-(4-methyl-phenyl-sulfon-yl)piperidine-3,5-diol | Acta crystallographica. Section E, Structure reports online |
| 22649749 | 2012-01-01 | Acylation of Chiral Alcohols: A Simple Procedure for Chiral GC Analysis | Journal of analytical methods in chemistry |
| 21120472 | 2011-03-01 | Purification, characterization, and cloning of a bifunctional molybdoenzyme with hydratase and alcohol dehydrogenase activity | Applied microbiology and biotechnology |
| 21588737 | 2010-08-28 | Cyclo-hexane-1,3-diyl bis-(N-phenyl-carbamate) | Acta crystallographica. Section E, Structure reports online |
| 16901110 | 2006-08-18 | Enzymatic resolution, desymmetrization, and dynamic kinetic asymmetric transformation of 1,3-cycloalkanediols | The Journal of organic chemistry |
| 12896934 | 2003-08-02 | Enzyme potentiated desensitisation in treatment of seasonal allergic rhinitis: double blind randomised controlled study | BMJ (Clinical research ed.) |
| 12661531 | 2003-01-01 | Alicycliphilus denitrificans gen. nov., sp. nov., a cyclohexanol-degrading, nitrate-reducing beta-proteobacterium | International journal of systematic and evolutionary microbiology |
