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1,2-Diacetoxypropane - >98.0%(GC), high purity , CAS No.623-84-7

COA

Grade & Purity:

≥98%(GC)

Cas Number: 623-84-7
Molecular Weight: 160.17
Beilstein Registry Number: 2(4)220
MDL number: MFCD00026201
PubChem CID: 12198
PubChem SID: 488181582

In stock

Item Number

D155571

Grouped product items
SKU	Size	Availability	Price
D155571-25ml	25ml	3	$9.90
D155571-100ml	100ml	3	$15.90
D155571-500ml	500ml	Available within 4-8 weeks(?) Items will be manufactured post-order and can take 4-8 weeks. Thank you for your patience!	$29.90

View related series

Carbonyl compound (2335) Carboxylate (915) Carboxylic acid ester (65) Esters_C7 (4) Non heterocyclic block (8163)

Basic Description

Synonyms	PGDA \| PROPYLENE GLYCOL DIACETATE [VANDF] \| CHEBI:173692 \| MFCD00026201 \| PROPYLENE GLYCOL DIACETATE [USP-RS] \| 1,2-Propanediol, diacetate \| Methylethylene diacetate \| F71222 \| 1,2-PROPYLENE DIACETATE \| FT-0658924 \| 1,2-Propyleneglycol diacetate \| CAS-623
Specifications & Purity	≥98%(GC)
Shipped In	Normal
Product Description	It is a non ionic water soluble surfactant. It may be used as an emulsifier, solubilizer or solvent in pharmaceuticals.

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Organic acids and derivatives
  - Class Carboxylic acids and derivatives
    - Subclass Dicarboxylic acids and derivatives

Kingdom	Organic compounds
Superclass	Organic acids and derivatives
Class	Carboxylic acids and derivatives
Subclass	Dicarboxylic acids and derivatives
Intermediate Tree Nodes	Not available
Direct Parent	Dicarboxylic acids and derivatives
Alternative Parents	Carboxylic acid esters Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework	Aliphatic acyclic compounds
Substituents	Dicarboxylic acid or derivatives - Carboxylic acid ester - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Carbonyl group - Aliphatic acyclic compound
Description	This compound belongs to the class of organic compounds known as dicarboxylic acids and derivatives. These are organic compounds containing exactly two carboxylic acid groups.
External Descriptors	Not available
1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61. DOI: 10.1186/s13321-016-0174-y

Names and Identifiers

Pubchem Sid	488181582
Pubchem Sid Url	https://pubchem.ncbi.nlm.nih.gov/substance/488181582
IUPAC Name	2-acetyloxypropyl acetate
INCHI	InChI=1S/C7H12O4/c1-5(11-7(3)9)4-10-6(2)8/h5H,4H2,1-3H3
InChIKey	MLHOXUWWKVQEJB-UHFFFAOYSA-N
Smiles	CC(COC(=O)C)OC(=O)C
Isomeric SMILES	CC(COC(=O)C)OC(=O)C
RTECS	TY4900000
Molecular Weight	160.17
Beilstein	2(4)220
Reaxy-Rn	1768914
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1768914&ln=

Certificates（CoA,COO,BSE/TSE and Analysis Chart)

C of A & Other Certificates(BSE/TSE, COO):

Analytical Chart:

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5 results found

Lot Number	Certificate Type	Date	Item
B2307141	Certificate of Analysis	Feb 18, 2023	D155571
B1928069	Certificate of Analysis	Dec 12, 2022	D155571
I1819098	Certificate of Analysis	Jul 22, 2022	D155571
G1825053	Certificate of Analysis	May 09, 2022	D155571
F2330095	Certificate of Analysis	Nov 18, 2021	D155571

Chemical and Physical Properties

Solubility	Solubility in water: Completely soluble; Soluble in Ether,Ethanol
Refractive Index	1.41
Flash Point(°C)	89°C(lit.)
Boil Point(°C)	186 °C
Melt Point(°C)	-31°C(lit.)
Molecular Weight	160.170 g/mol
XLogP3	0.700
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	5
Exact Mass	160.074 Da
Monoisotopic Mass	160.074 Da
Topological Polar Surface Area	52.600 Å²
Heavy Atom Count	11
Formal Charge	0
Complexity	153.000
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
The total count of all stereochemical bonds	0
Covalently-Bonded Unit Count	1

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