2-(2-Propen-1-yl)propanedioic acid
Properties
- Molecular formula
- C6H8O4
- Molar mass
- 144.13 g/mol
- Exact mass
- 144.0423 Da
- Melting point
- 105 °C
- logP
- 0.35Crippen estimate
- Polar surface area
- 74.6 Ų
- H-bond donors / acceptors
- 2 / 2
- Rotatable bonds
- 4
Hazards
Warning
- H315 Causes skin irritation100% of notifiers
- H319 Causes serious eye irritation100% of notifiers
- H335 May cause respiratory irritation100% of notifiers
Aggregated from 43 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.
Precautionary statements
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501
Identifiers
CAS number
2583-25-7SMILES
C=CCC(C(=O)O)C(=O)OInChIKey
ZDZVKPXKLLLOOA-UHFFFAOYSA-NInChI
InChI=1S/C6H8O4/c1-2-3-4(5(7)8)6(9)10/h2,4H,1,3H2,(H,7,8)(H,9,10)Weigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
7 names
- Propanedioic acid, 2-(2-propen-1-yl)-
- Malonic acid, allyl-
- Propanedioic acid, 2-propenyl-
- 3-Butene-1,1-dicarboxylic acid
- Allylmalonic acid
- NSC 46718
- 2-Allylmalonic acid
Work with 2-(2-Propen-1-yl)propanedioic acid
Similar compounds
2-Methyl-4-pentenoic acid1575-74-261 % similar
s-Allylglycine16338-48-061 % similar
D-Allylglycine54594-06-861 % similar
Allylglycine7685-44-161 % similar
D-2-Allylglycine hydrochloride108412-04-055 % similar
L-2-Allylglycine hydrochloride195316-72-455 % similar
2-Methylidenecyclopropane-1-carboxylic acid62266-36-846 % similar
Dimethyl allylmalonate40637-56-745 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue.