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Home › Product Catalog › (3aS,4S,5R,6aR)-Hexahydro-5-hydroxy-4-(hydroxyMethyl)-2(1H)-pentalenone

(3aS,4S,5R,6aR)-Hexahydro-5-hydroxy-4-(hydroxyMethyl)-2(1H)-pentalenone

CAS 94595-91-2C9H14O3MW 170.21

(3aS,4S,5R,6aR)-Hexahydro-5-hydroxy-4-(hydroxyMethyl)-2(1H)-pentalenone (CAS 94595-91-2) — formula C9H14O3, molecular weight 170.21; category organic chemicals.

Product Description

(3aS,4S,5R,6aR)-Hexahydro-5-hydroxy-4-(hydroxyMethyl)-2(1H)-pentalenone (CAS 94595-91-2) is a chemical raw material in the organic chemicals category. Its molecular formula C9H14O3 comprises 9 C, 14 H, 3 O atoms. Its molecular weight is about 170.21. Reported physicochemical data: LogP about -0.2. As a sourcing and distribution partner we help locate and compare this item across domestic and cross-border channels, arranging samples and batch orders with full COA and compliance files.

Product Overview

CAS Number94595-91-2
Molecular FormulaC9H14O3
Molecular Weight170.21
LogP-0.2
CategoryOrganic Chemicals

Technical Profile

What this product is

(3aS,4S,5R,6aR)-Hexahydro-5-hydroxy-4-(hydroxyMethyl)-2(1H)-pentalenone is a carbon-based organic compound with CAS registry number 94595-91-2 and molecular formula C9H14O3 (molecular weight 170.21), belonging to the organic chemicals segment of chemical raw materials.

Identification

CAS number: 94595-91-2

Its molecular formula C9H14O3 comprises 9 C, 14 H, 3 O atoms.

Also known as: (3aS,4S,5R,6aR)-Hexahydro-5-hydroxy-4-(hydroxyMethyl)-2(1H)-pentalenone · (3aS,4S,5R,6aR)-六氢-5-羟基-4-(羟基甲基)-2(1H)-戊烯酮

Category: organic chemicals

Frequently Asked Questions

What is the CAS number of (3aS,4S,5R,6aR)-Hexahydro-5-hydroxy-4-(hydroxyMethyl)-2(1H)-pentalenone?

The CAS registry number of (3aS,4S,5R,6aR)-Hexahydro-5-hydroxy-4-(hydroxyMethyl)-2(1H)-pentalenone is 94595-91-2.

What is the molecular formula and molecular weight of (3aS,4S,5R,6aR)-Hexahydro-5-hydroxy-4-(hydroxyMethyl)-2(1H)-pentalenone?

Molecular formula C9H14O3, molecular weight 170.21.

What other names is (3aS,4S,5R,6aR)-Hexahydro-5-hydroxy-4-(hydroxyMethyl)-2(1H)-pentalenone known by?

It is also registered under: (3aS,4S,5R,6aR)-Hexahydro-5-hydroxy-4-(hydroxyMethyl)-2(1H)-pentalenone, (3aS,4S,5R,6aR)-六氢-5-羟基-4-(羟基甲基)-2(1H)-戊烯酮.

Which category does (3aS,4S,5R,6aR)-Hexahydro-5-hydroxy-4-(hydroxyMethyl)-2(1H)-pentalenone belong to?

Category: Organic Chemicals.

Packaging & documentation

Packaging is agreed per order, from lab-scale packs to bulk, and confirmed with each order rather than fixed on the page. A Certificate of Analysis (COA) ships with every batch and MSDS is available; where the end use carries a regulatory limit (food contact, pharmaceutical or cosmetic), state the standard at enquiry and the grade is set against it.

PubChem Public Data

Independent reference data for (3aS,4S,5R,6aR)-Hexahydro-5-hydroxy-4-(hydroxyMethyl)-2(1H)-pentalenone (CAS 94595-91-2), compiled from public chemistry databases.

Registry identifiers across databases

CAS Number94595-91-2
PubChem CID12877553
Molecular FormulaC9H14O3
IUPAC Name5-hydroxy-4-(hydroxymethyl)-3,3a,4,5,6,6a-hexahydro-1H-pentalen-2-one

Computed descriptors

Molecular Weight170.21
XLogP3-0.2
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count3
Rotatable Bond Count1
Exact Mass170.094294304
Monoisotopic Mass170.094294304
Topological Polar Surface Area57.5
Heavy Atom Count12

Synonyms and trade names

94595-91-2; 5-hydroxy-4-(hydroxymethyl)-3,3a,4,5,6,6a-hexahydro-1H-pentalen-2-one; SCHEMBL9637857; (3aS,4S,5R,6aR)-hexahydro-5-hydroxy-4-(hydroxymethyl)-2(1H)-pentalenone; DB-079967

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

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Supplier: Jinan Shenghe Chemical Co., Ltd.

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