Monomers
Dimethyl maleate
Identifiers
IUPAC name
dimethyl (Z)-but-2-enedioate
InchI
InChI=1S/C6H8O4/c1-9-5(7)3-4-6(8)10-2/h3-4H,1-2H3/b4-3-
InchI Key
LDCRTTXIJACKKU-ARJAWSKDSA-N
SMILES
COC(=O)/C=C\C(=O)OC
Canonical SMILES
COC(=O)C=CC(=O)OC
Isomeric SMILES
COC(=O)/C=C\C(=O)OC
Resources
Structures
2D Structure
3D Structure
Molecular Formula and Computed Descriptors
Molecular Formula
C6H8O4
Heavy Atom Count
10
Molecular Weight
144.126
Exact Molecular Weight
144.0423
Valence Electrons
56
Radical Electrons
0
tPSA
52.6
MolLogP
-0.1114
H Bond Acceptors
4
H Bond Donors
0
Aliphatic Carbocycles
0
Aromatic Carbocycles
0
Aliphatic Heterocycles
0
Aromatic Heterocycles
0
Aliphatic Rings
0
Aromatic Rings
0
MOL File
RDKit 3D
18 17 0 0 0 0 0 0 0 0999 V2000
4.1133 -0.1938 0.3453 C 0 0 0 0 0 0 0 0 0 0 0 0
2.7427 0.0225 0.5881 O 0 0 0 0 0 0 0 0 0 0 0 0
1.7387 -0.2665 -0.3070 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0732 -0.7561 -1.4139 O 0 0 0 0 0 0 0 0 0 0 0 0
0.3263 -0.0385 -0.0447 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.5701 -0.3454 -0.9610 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.0042 -0.1383 -0.7532 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.8600 -0.4233 -1.6089 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.4119 0.4006 0.4572 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.8082 0.6176 0.6964 C 0 0 0 0 0 0 0 0 0 0 0 0
4.3534 0.3100 -0.6318 H 0 0 0 0 0 0 0 0 0 0 0 0
4.3829 -1.2441 0.2342 H 0 0 0 0 0 0 0 0 0 0 0 0
4.7053 0.3247 1.1258 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.0013 0.3837 0.9020 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.2431 -0.7650 -1.9015 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.9704 1.5496 1.2909 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.3451 0.7816 -0.2673 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.2213 -0.2192 1.2780 H 0 0 0 0 0 0 0 0 0 0 0 0
1 2 1 0
2 3 1 0
3 4 2 0
3 5 1 0
5 6 2 3
6 7 1 0
7 8 2 0
7 9 1 0
9 10 1 0
1 11 1 0
1 12 1 0
1 13 1 0
5 14 1 0
6 15 1 0
10 16 1 0
10 17 1 0
10 18 1 0
M END
Similar Monomers
Structure
Similarity
IUPAC name
MF
Copolymers