Dodecenylsuccinic anhydride

C₁₆H₂₆O₃CAS 25377-73-5266.38 g/mol

Open in Covalent MOL file

Acid anhydride Alkene

Properties

Molecular formula: C₁₆H₂₆O₃
Molar mass: 266.38 g/mol
Exact mass: 266.1882 Da
Density: 1.002 g/mL (at 25 °C)
Melting point: 139–142 °C
Boiling point: 100–110 °C (at 1 Torr)
logP: 4.16Crippen estimate
Polar surface area: 43.4 Å²
H-bond donors / acceptors: 0 / 3
Rotatable bonds: 10
Double bonds: EE/Z, in SMILES order

Hazards

Warning

H315 Causes skin irritation92.3% of notifiers
H317 May cause an allergic skin reaction17% of notifiers
H319 Causes serious eye irritation93.3% of notifiers
H332 Harmful if inhaled11.2% of notifiers
H412 Harmful to aquatic life with long lasting effects61.6% of notifiers

Aggregated from 731 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P264, P264+P265, P271, P272, P273, P280, P302+P352, P304+P340, P305+P351+P338, P317, P321, P332+P317, P333+P317, P337+P317, P362+P364, P501

Identifiers

CAS number

25377-73-5

SMILES

CCCCCCCCCC/C=C/C1CC(=O)OC1=O

InChIKey

WVRNUXJQQFPNMN-VAWYXSNFSA-N

InChI

InChI=1S/C16H26O3/c1-2-3-4-5-6-7-8-9-10-11-12-14-13-15(17)19-16(14)18/h11-12,14H,2-10,13H2,1H3/b12-11+

Weigh it out

Type any one amount. The others follow from the molar mass and density.

Names and synonyms

11 names

2,5-Furandione, 3-(dodecen-1-yl)dihydro-
2,5-Furandione, 3-(dodecenyl)dihydro-
Succinic anhydride, dodecenyl-
3-(Dodecen-1-yl)dihydro-2,5-furandione
Dodecenylsuccinic acid anhydride
2-(Dodecenyl)succinic anhydride
DDSA
Rikacid DDSA
K 12
K 12 (Anhydride)
3-Dodecenyl succinic anhydride

Work with Dodecenylsuccinic anhydride

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 Isotope patternExact mass and the mass spectrum pattern

Similar compounds

1-Octenyl succinic anhydride26680-54-6100 % similar Octadecenylsuccinic anhydride28777-98-2100 % similar Nonenylsuccinic anhydride28928-97-4100 % similar 2-Octenylsuccinic anhydride42482-06-461 % similar Dodecylsuccinic anhydride2561-85-559 % similar Oleic anhydride24909-72-651 % similar Dodecenylsuccinic acid29658-97-751 % similar Isopropyl oleate112-11-845 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

3-(2-Dodecen-1-yl)dihydro-2,5-furandione19780-11-1 (Tetrapropenyl)succinic anhydride26544-38-7

Elsewhere

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