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1119-40-0

1119-40-0 structural image
Product Name: Dimethyl Glutarate
Formula: C7H12O4
Synonyms: Dimethyl glutarate;Glutaric acid dimethyl ester;Pentanedioic acid dimethyl ester
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CHEMICAL AND PHYSICAL PROPERTIES

Physical Description Dimethyl glutarate is a colorless liquid. (USCG, 1999)
Color/Form LIQUID
Odor FAINT AGREEABLE ODOR
Boiling Point 199.4 to 203 °F at 13 mmHg (USCG, 1999)
Melting Point -42.5 °C
Flash Point 218 °F (USCG, 1999)
Solubility VERY SOL IN ALC, ETHER
Density 1.087 (USCG, 1999) - Denser than water; will sink
Ionization Efficiency Positive
Refractive Index INDEX OF REFRACTION: 1.4242 @ 20 °C/D; SADTLER REFERENCE NUMBER: 692 (IR, PRISM)
Kovats Retention Index 1105 1099 1100 1102 1104 1106 1107 1108 1109 1104.5 1103 1103 1105 1102 1109.4
Chemical Classes Other Classes -> Esters, Other

SAFETY INFORMATION

Signal word Warning
Pictogram(s)

Exclamation Mark
Irritant
GHS07
GHS Hazard Statements H302:Acute toxicity,oral
Precautionary Statement Codes P280:Wear protective gloves/protective clothing/eye protection/face protection.
P305+P351+P338:IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continuerinsing.

COMPUTED DESCRIPTORS

Molecular Weight 160.17 g/mol
XLogP3 0.6
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 6
Exact Mass 160.07355886 g/mol
Monoisotopic Mass 160.07355886 g/mol
Topological Polar Surface Area 52.6 Ų
Heavy Atom Count 11
Formal Charge 0
Complexity 125
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes

PRODUCT INTRODUCTION

description

Dimethyl glutarate is a colorless liquid. (USCG, 1999)