Monomethyl fumarate
Properties
- Molecular formula
- C5H6O4
- Molar mass
- 130.10 g/mol
- Exact mass
- 130.0266 Da
- Density
- 1.37 g/mL (at 20 °C)
- Melting point
- 143 °C
- logP
- -0.20Crippen estimate
- Polar surface area
- 63.6 Ų
- H-bond donors / acceptors
- 1 / 3
- Rotatable bonds
- 2
- Double bonds
- EE/Z, in SMILES order
Hazards
Danger
- H318 Causes serious eye damage72.3% of notifiers
Aggregated from 141 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.
Precautionary statements
P264+P265, P280, P305+P354+P338, P317
Identifiers
CAS number
2756-87-8SMILES
COC(=O)/C=C/C(=O)OInChIKey
NKHAVTQWNUWKEO-NSCUHMNNSA-NInChI
InChI=1S/C5H6O4/c1-9-5(8)3-2-4(6)7/h2-3H,1H3,(H,6,7)/b3-2+Weigh it out
Type any one amount. The others follow from the molar mass and density.
Names and synonyms
8 names
- 2-Butenedioic acid (2E)-, 1-methyl ester
- Fumaric acid, monomethyl ester
- Fumaric acid, methyl ester
- 2-Butenedioic acid (E)-, monomethyl ester
- 2-Butenedioic acid (2E)-, monomethyl ester
- Methyl hydrogen fumarate
- (E)-4-Methoxy-4-oxobut-2-enoic acid
- (E)-4-Methoxy-4-oxo-but-2-enoic acid
Work with Monomethyl fumarate
Stereoisomers, salts and isotopologues
The same compound in another form: other stereochemistry, a salt or hydrate, the free acid or base, or an isotope-labelled version.
Similar compounds
Dimethyl maleate624-48-668 % similar
Dimethyl fumarate624-49-768 % similar
Monoethyl fumarate2459-05-457 % similar
Maleic acid110-16-755 % similar
Fumaric acid110-17-855 % similar
Poly(maleic acid)26099-09-255 % similar
Methyl crotonate623-43-854 % similar
Maleic acid-methyl vinyl ether copolymer25153-40-650 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds