Home Other Building Blocks trans-1,4-Cyclohexanediol

trans-1,4-Cyclohexanediol

CAS No.:
6995-79-5
Catalog Number:
AG0035PZ
Molecular Formula:
C6H12O2
Molecular Weight:
116.1583
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$19
- +
5g
98%
In Stock USA
United States
$63
- +
10g
98%
In Stock USA
United States
$113
- +
25g
98%
In Stock USA
United States
$200
- +
100g
98%
In Stock USA
United States
$688
- +
Product Description
Catalog Number:
AG0035PZ
Chemical Name:
trans-1,4-Cyclohexanediol
CAS Number:
6995-79-5
Molecular Formula:
C6H12O2
Molecular Weight:
116.1583
MDL Number:
MFCD00063612
IUPAC Name:
cyclohexane-1,4-diol
InChI:
InChI=1S/C6H12O2/c7-5-1-2-6(8)4-3-5/h5-8H,1-4H2
InChI Key:
VKONPUDBRVKQLM-UHFFFAOYSA-N
SMILES:
O[C@@H]1CC[C@H](CC1)O
Properties
Complexity:
54.9  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
116.084g/mol
Formal Charge:
0
Heavy Atom Count:
8  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
116.16g/mol
Monoisotopic Mass:
116.084g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
40.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.2  
Literature
Title Journal
Synergistic effect of 1,4-cyclohexanediol and 1,2-hexanediol on percutaneous absorption and penetration of metronidazole. International journal of pharmaceutics 20110830
2-[(1R*,4R*)-1,4-Dihy-droxy-cyclo-hex-yl]acetic acid. Acta crystallographica. Section E, Structure reports online 20110401
Effect of 1,4-cyclohexanediol on percutaneous absorption and penetration of azelaic acid. International journal of pharmaceutics 20100315
Oxidation of cyclohexanediol derivatives with 12-tungstophosphoric acid-hydrogen peroxide system. Journal of oleo science 20090101
Hydrogen-bond patterns and the structures of 1,4-cyclohexanediol: 2:1 cis:trans-1,4-cyclohexanediol. Acta crystallographica. Section B, Structural science 20081001
Studies on 1-alkylamine adduct formation in electrospray ionization mass spectrometry for quantitative analysis. Journal of pharmaceutical and biomedical analysis 20080805
trans-Cyclo-hexane-1,4-diyl bis-(4-nitro-phen-yl) dicarbonate. Acta crystallographica. Section E, Structure reports online 20080101
A gene linB2 responsible for the conversion of beta-HCH and 2,3,4,5,6-pentachlorocyclohexanol in Sphingomonas sp. BHC-A. Applied microbiology and biotechnology 20070101
Hyperconjugation and the increasing bulk of OCOCX3 substituents in trans-1,4-disubstituted cyclohexanes destabilize the diequatorial conformer. The Journal of organic chemistry 20060609
Natural and synthetic polyesters for musculoskeletal tissue repair: experimental in vitro and in vivo evaluations. The International journal of artificial organs 20040901
Properties