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105-76-0 | Dibutyl maleate
CAS No: 105-76-0 Catalog No: AG003PCA MDL No:MFCD00009447
Product Description
Catalog Number:
AG003PCA
Chemical Name:
Dibutyl maleate
CAS Number:
105-76-0
Molecular Formula:
C12H20O4
Molecular Weight:
228.2848
MDL Number:
MFCD00009447
IUPAC Name:
dibutyl (Z)-but-2-enedioate
InChI:
InChI=1S/C12H20O4/c1-3-5-9-15-11(13)7-8-12(14)16-10-6-4-2/h7-8H,3-6,9-10H2,1-2H3/b8-7-
InChI Key:
JBSLOWBPDRZSMB-FPLPWBNLSA-N
SMILES:
CCCCOC(=O)/C=C\C(=O)OCCCC
EC Number:
203-328-4
UNII:
4X371TMK9K
NSC Number:
6711
Properties
Complexity:
209
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1
Exact Mass:
228.136g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
228.288g/mol
Monoisotopic Mass:
228.136g/mol
Rotatable Bond Count:
10
Topological Polar Surface Area:
52.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7
Literature
| Title | Journal |
|---|---|
| Structure-activity comparison of the cytotoxic properties of diethyl maleate and related molecules: identification of diethyl acetylenedicarboxylate as a thiol cross-linking agent. | Chemical research in toxicology 20110114 |
| Allergic contact dermatitis from occupational exposure to dibutyl maleate. | Contact dermatitis 20090501 |
| Composition-explicit distillation curves of diesel fuel with glycol ether and glycol ester oxygenates: fuel analysis metrology to enable decreased particulate emissions. | Environmental science & technology 20081015 |
| Poly(2-hydroxy-3-phenoxypropylacrylate, 4-hydroxybutyl acrylate, dibutyl maleate) membrane controlled clonidine zero-order release. | European journal of pharmaceutics and biopharmaceutics : official journal of Arbeitsgemeinschaft fur Pharmazeutische Verfahrenstechnik e.V 20070601 |
| Microsphere-based protease assays and screening application for lethal factor and factor Xa. | Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501 |
| Biodegradation of potential diesel oxygenate additives: dibutyl maleate (DBM), and tripropylene glycol methyl ether (TGME). | Chemosphere 20030801 |
| Antifungal properties of 2-bromo-3-fluorosuccinic acid esters and related compounds. | Journal of medicinal chemistry 19770401 |
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