1-O-辛基-β-D-吡喃葡萄糖苷

Description

1-O-octyl-β-D-glucopyranoside · CAS 29836-26-8 · C14H28O6. UNII V109WUT6RL.

Identification

CAS Registry Number	29836-26-8
PubChem CID	62852
Molecular formula	C14H28O6
IUPAC name	(2R,3S,4S,5R,6R)-2-(hydroxymethyl)-6-octoxyoxane-3,4,5-triol
UNII (FDA)	V109WUT6RL

Computed Descriptors

Molecular Weight	292.37
XLogP3	1.4
Hydrogen Bond Donor Count	4
Hydrogen Bond Acceptor Count	6
Rotatable Bond Count	9
Exact Mass	292.18858861
Monoisotopic Mass	292.18858861
Topological Polar Surface Area	99.4
Heavy Atom Count	20
Formal Charge	0

Physical description & handling notes

• White solid; [Merck Index] White to off-white hygroscopic powder; [Alfa Aesar MSDS]
• 180.1 Ų [M-H]- [CCS Type: DT; Buffer gas: N2; Ionization: ESI-; Dataset: TOXCAST; Source Identifier: DTXSID6042234]
• 181.2 Ų [M+Na]+ [CCS Type: DT; Buffer gas: N2; Ionization: ESI+; Dataset: TOXCAST; Source Identifier: DTXSID6042234]

Regulatory Status

Regulatory & Food Contact	CIR / INCI: Cosmetic ingredients (Caprylyl Glucoside) -> CIR (Cosmetic Ingredient Review)
GHS notification summary	50% (3 / 6)

GHS Hazard Classification

GHS notification summary	50% (3 / 6)
Reported hazard statements	H315 (50%), H319 (50%), H335 (50%)

Documented Uses

• CIR ingredient: Caprylyl Glucoside
• EPA Safer Chemical Functional Use Classes -> Surfactants
• Safer Chemical Classes -> Green circle - The chemical has been verified to be of low concern
• Information on 3 consumer products that contain Caprylyl Glucoside in the following categories is provided:
• Purifying or cleansing agents, usually salts of long-chain aliphatic bases or acids, that exert cleansing (oil-dissolving) and antimicrobial effects through a surface action that depends on possessing both hydrophilic and hydrophobic properties.

Synonyms

29836-26-8; OCTYL BETA-D-GLUCOPYRANOSIDE; n-Octyl-beta-D-glucopyranoside; 1-O-n-Octyl-beta-D-glucopyranoside; caprylyl glucoside; beta-D-Octyl glucoside; Octyl-beta-D-glucoside; octylglucoside; (2R,3S,4S,5R,6R)-2-(hydroxymethyl)-6-octoxyoxane-3,4,5-triol; DTXSID6042234; V109WUT6RL; beta-D-Glucopyranoside, octyl; DTXCID4022234; CHEBI:41128; octylglucopyranoside; beta-octyl-d-glucoside

Frequently Asked Questions

What are the CAS number and molecular formula of 1-O-octyl-β-D-glucopyranoside?

CAS 29836-26-8; molecular formula C14H28O6; molecular weight — g/mol.

What other names is 1-O-octyl-β-D-glucopyranoside known by?

29836-26-8, OCTYL BETA-D-GLUCOPYRANOSIDE, n-Octyl-beta-D-glucopyranoside, 1-O-n-Octyl-beta-D-glucopyranoside, caprylyl glucoside, beta-D-Octyl glucoside.

What is the regulatory status of 1-O-octyl-β-D-glucopyranoside?

Documented regulatory listings: CIR / INCI: Cosmetic ingredients (Caprylyl Glucoside) -> CIR (Cosmetic Ingredient Review).

Is 1-O-octyl-β-D-glucopyranoside classified as hazardous?

50% of GHS notifications report no hazard classification (3 of 6).

Facts on this page are taken from PubChem (US National Library of Medicine) and Wikidata. Grade-specific data — assay, moisture, particle size, packaging, shelf life — is issued per batch on the COA and is not published here.