1,2-decanediol
Product Information
Molecular Formula
C10H22O2
Molecular Weight
174.28
Description
Decane-1,2-diol is a glycol that is decane bearing two hydroxy substituents located at positions 1 and 2. It has a role as an anti-inflammatory agent, an antioxidant and a human metabolite. It is a glycol and a volatile organic compound. It derives from a hydride of a decane.
Synonyms
1,2-DECANEDIOL; 1,2-DIHYDROXYDECANE; decane-1,2-diol; Decan-1,2-diol; 1,2-Decanediol, GC 98%; 1,2-Decandiol, 98%; 1,2-DECANEDIOL 99+%; 1,2-Decanediol,98%
IUPAC Name
decane-1,2-diol
SMILES
CCCCCCCCC(CO)O
InChI
InChI=1S/C10H22O2/c1-2-3-4-5-6-7-8-10(12)9-11/h10-12H,2-9H2,1H3
InChI Key
YSRSBDQINUMTIF-UHFFFAOYSA-N
Boiling Point
255 °C (lit.)
Melting Point
48-50 °C (lit.)
Flash Point
Not applicable
Purity
98%
Density
0.922 g/cm3
Computed Properties
XLogP3
2.9
Hydrogen Bond Donor Count
2
Hydrogen Bond Acceptor Count
2
Rotatable Bond Count
8
Exact Mass
174.161979940 g/mol
Monoisotopic Mass
174.161979940 g/mol
Topological Polar Surface Area
40.5Ų
Heavy Atom Count
12
Formal Charge
0
Complexity
83.9
Isotope Atom Count
0
Defined Atom Stereocenter Count
0
Undefined Atom Stereocenter Count
1
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-114053162-A | Sorbic acid-containing preservative composition with stable color and application thereof | 2021-12-23 |
| CN-114181784-A | Composition for cleaning blue-light-proof resin lens and preparation method and application thereof | 2021-12-09 |
| JP-2022036981-A | Cosmetic blend | 2021-11-19 |
| 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-113788878-A | Self-assembled short peptide, and application thereof in broad-spectrum vaccine and biomedicine | 2021-09-24 |
| JP-6998490-B1 | Ink composition for photocurable inkjet printing | 2021-08-30 |
| WO-2021224509-A2 | Antimicrobial combinations | 2021-08-27 |
| CN-113583229-A | Preparation method of degradable hyperbranched aliphatic polycarbonate | 2021-07-12 |
| JP-6960555-B1 | Ink composition for active energy ray-curable inkjet | 2021-06-29 |
| CN-113521027-A | Microcapsule preparation rich in astaxanthin, preparation method and application thereof | 2021-06-07 |
Literatures
| PMID | Publication Date | Title | Journal |
|---|---|---|---|
| 22523593 | 2012-01-01 | 1,2-Octanediol, a novel surfactant, for treating head louse infestation: identification of activity, formulation, and randomised, controlled trials | PloS one |
| 21585401 | 2011-10-01 | The influence of alkane chain length on the skin irritation potential of 1,2-alkanediols | International journal of cosmetic science |
| 11536219 | 2001-08-01 | Influences of alkyl group chain length and polar head group on chemical skin permeation enhancement | Journal of pharmaceutical sciences |
