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D-chiro-Inositol

CAS 87-89-8C6H12O6MW 180.16

D-chiro-Inositol (CAS 87-89-8) — formula C6H12O6, molecular weight 180.16.

Product Overview

CAS Number87-89-8
Molecular FormulaC6H12O6
Molecular Weight180.16
LogP-3.7
ApplicationsHumectant, Antistatic, Hair conditioning

Applications

Documented applications: Humectant, Antistatic, Hair conditioning.

Technical Profile

What this product is

D-chiro-Inositol is a chemical compound with CAS registry number 87-89-8 and molecular formula C6H12O6 (molecular weight 180.16).

Identification

CAS number: 87-89-8

Its molecular formula C6H12O6 comprises 6 C, 12 H, 6 O atoms.

Also known as: D-chiro-Inositol · Inositol · Cyclohexane-1,2,3,4,5,6-hexol

Frequently Asked Questions

What is the CAS number of D-chiro-Inositol?

The CAS registry number of D-chiro-Inositol is 87-89-8.

What is the molecular formula and molecular weight of D-chiro-Inositol?

Molecular formula C6H12O6, molecular weight 180.16.

What other names is D-chiro-Inositol known by?

It is also registered under: D-chiro-Inositol, Inositol, Cyclohexane-1,2,3,4,5,6-hexol.

What are the documented applications of D-chiro-Inositol?

Recorded applications: Humectant, Antistatic, Hair conditioning.

PubChem Public Data

Independent reference data for D-chiro-Inositol (CAS 87-89-8), compiled from public chemistry databases.

Registry identifiers across databases

CAS 号87-89-8
PubChem CID892
分子式C6H12O6
分子量180.06 g/mol
IUPAC 名称cyclohexane-1,2,3,4,5,6-hexol
InChIKeyCDAISMWEOUEBRE-GPIVLXJGSA-N
UNII(FDA)4L6452S749
ChEBI 编号CHEBI:17268

Computed descriptors

Molecular Weight180.16
XLogP3-3.7
Hydrogen Bond Donor Count6
Hydrogen Bond Acceptor Count6
Rotatable Bond Count0
Exact Mass180.06338810
Monoisotopic Mass180.06338810
Topological Polar Surface Area121
Heavy Atom Count12

Physicochemical values on record

Collision Cross Section148.7 Ų [M+Na]+
Collision Cross Section131.5 Ų [M-H]-

Synonyms and trade names

an inositol; RefChem:1076961; Scyllo-inositol; inositol; myo-inositol; Muco-Inositol; epi-Inositol; Allo-inositol; D-chiro-Inositol; i-Inositol; 87-89-8; meso-Inositol; 643-12-9; 1D-Chiro-inositol; 488-59-5; Neo-inositol

Regulatory listings held on file

法规与食品接触CIR / INCI: Antistatic; Humectant; Hair conditioning
GHS 通报统计100% (4 / 4)

GHS hazard classification

GHS 通报统计100% (4 / 4)
已通报的危害声明H315 (100%), H319 (100%), H335 (100%)

What the public record says

肌醇 的 CAS 号为 87-89-8,分子式 C6H12O6,分子量 180.06 g/mol。 UNII 4L6452S749; ChEBI 17268; InChIKey CDAISMWEOUEBRE-GPIVLXJGSA-N. Collision Cross Section: 148.7 Ų [M+Na]+; Collision Cross Section: 131.5 Ų [M-H]-.

Source: PubChem / Wikidata; the batch COA governs where values differ.

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