1,2-decanediol

Inquiry

Molecular Formula:

C10H22O2

Molecular Weight:

174.28

CAS Number:

1119-86-4

Catalog Number:

1119-86-4

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

Canonical 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

Hydrogen Bond Acceptor Count

Rotatable Bond Count

Exact Mass

174.161979940 g/mol

Monoisotopic Mass

174.161979940 g/mol

Topological Polar Surface Area

40.5Å²

Heavy Atom Count

Formal Charge

Complexity

83.9

Isotope Atom Count

Defined Atom Stereocenter Count

Undefined Atom Stereocenter Count

Defined Bond Stereocenter Count

Undefined Bond Stereocenter Count

Covalently-Bonded Unit Count

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

The molarity calculator equation

Mass (g) = Concentration (mol/L) × Volume (L) × Molecular Weight (g/mol)

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The dilution calculator equation

Concentration _(start) × Volume _(start) = Concentration _(final) × Volume _(final)

This equation is commonly abbreviated as: C₁V₁ = C₂V₂

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