Glycol diformate
Properties
- Molecular formula
- C4H6O4
- Molar mass
- 118.09 g/mol
- Exact mass
- 118.0266 Da
- Density
- 1.1503 g/mL (at 20 °C)
- Boiling point
- 174 °C
- Flash point
- 93.3 °C
- logP
- -0.67Crippen estimate
- Polar surface area
- 52.6 Ų
- H-bond donors / acceptors
- 0 / 4
- Rotatable bonds
- 5
Hazards
Danger
- H302 Harmful if swallowed74.1% of notifiers
- H315 Causes skin irritation20.7% of notifiers
- H318 Causes serious eye damage62.9% of notifiers
- H319 Causes serious eye irritation26.7% of notifiers
Aggregated from 116 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.
Precautionary statements
P264, P264+P265, P270, P280, P301+P317, P302+P352, P305+P351+P338, P305+P354+P338, P317, P321, P330, P332+P317, P337+P317, P362+P364, P501
Identifiers
CAS number
629-15-2SMILES
O=COCCOC=OInChIKey
IKCQWKJZLSDDSS-UHFFFAOYSA-NInChI
InChI=1S/C4H6O4/c5-3-7-1-2-8-4-6/h3-4H,1-2H2Weigh it out
Type any one amount. The others follow from the molar mass and density.
Names and synonyms
8 names
- 1,2-Ethanediol, 1,2-diformate
- Ethylene glycol, diformate
- 1,2-Ethanediol, diformate
- Ethylene formate
- Ethylene diformate
- NSC 8831
- 1,2-Diformyloxyethane
- 2-(Formyloxy)ethyl formate
Work with Glycol diformate
Predict the NMR spectrum1H and 13C shifts with multiplicities
Make a solutionWhat to weigh for any molarity and volume
Check drug-likenessLipinski, Veber and lead-likeness
Boiling point under vacuumAt any pressure, from its normal boiling point
Isotope patternExact mass and the mass spectrum pattern
Similar compounds
Propyl formate110-74-761 % similar
Butyl formate592-84-755 % similar
Isoamyl formate110-45-252 % similar
Pentyl formate638-49-352 % similar
Ethyl formate109-94-450 % similar
Hexyl formate629-33-450 % similar
2-Phenylethyl formate104-62-148 % similar
cis-3-Hexenyl formate33467-73-148 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue.