Butyl glycolate - CAS 7397-62-8

Catalog:	BB034964
Product Name:	Butyl glycolate
CAS:	7397-62-8
Synonyms:	butyl 2-hydroxyacetate

Technical Data

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Computed Properties

IUPAC Name:	butyl 2-hydroxyacetate
Description:	Butyl glycolate (CAS# 7397-62-8) is a useful research chemical.
Molecular Weight:	132.16
Molecular Formula:	C6H12O3
Canonical SMILES:	CCCCOC(=O)CO
InChI:	InChI=1S/C6H12O3/c1-2-3-4-9-6(8)5-7/h7H,2-5H2,1H3
InChI Key:	VFGRALUHHHDIQI-UHFFFAOYSA-N
Boiling Point:	183 °C at 760 mmHg
Melting Point:	-26 °C
Purity:	95 %
Density:	1.019 g/cm³
Solubility:	Water : 46 g/L at 20 °C (68 °F) - soluble;
Appearance:	Clear liquid
LogP:	0.32200

Publication Number	Title	Priority Date
CN-113336739-A	Method for preparing high-purity glycolide	20210625
CN-113203823-A	Application of hydroxyl-containing compound, matrix improver and method for analyzing flavor components in tobacco	20210421
CN-112958030-A	System and method for efficiently synthesizing glycolide	20210402
CN-113089045-A	Dyeing method, shell and terminal equipment	20210329
CN-112831031-A	Preparation method of polyglycolic acid	20210311

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GHS Hazard Statement:	H318 (100%): Causes serious eye damage [Danger Serious eye damage/eye irritation]
Precautionary Statement:	P280, P305+P351+P338, and P310
Signal Word:	Danger

Complexity:	80.4
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	132.078644241
Formal Charge:	0
Heavy Atom Count:	9
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	132.078644241
Rotatable Bond Count:	5
Topological Polar Surface Area:	46.5 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	0.7