Monomers
Acrylic anhydride
Identifiers
IUPAC name
prop-2-enoyl prop-2-enoate
InchI
InChI=1S/C6H6O3/c1-3-5(7)9-6(8)4-2/h3-4H,1-2H2
InchI Key
ARJOQCYCJMAIFR-UHFFFAOYSA-N
SMILES
C=CC(=O)OC(=O)C=C
Canonical SMILES
C=CC(=O)OC(=O)C=C
Isomeric SMILES
C=CC(=O)OC(=O)C=C
Resources
Structures
2D Structure
3D Structure
Molecular Formula and Computed Descriptors
Molecular Formula
C6H6O3
Heavy Atom Count
9
Molecular Weight
126.111
Exact Molecular Weight
126.0317
Valence Electrons
48
Radical Electrons
0
tPSA
43.37
MolLogP
0.4282
H Bond Acceptors
3
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
15 14 0 0 0 0 0 0 0 0999 V2000
-2.2336 1.3390 0.7458 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.4330 0.0600 0.4791 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.3371 -0.7863 0.0285 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.5211 -2.0048 -0.2269 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.0718 -0.2347 -0.1196 O 0 0 0 0 0 0 0 0 0 0 0 0
0.9825 -1.0294 -0.5482 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7198 -2.2369 -0.7833 O 0 0 0 0 0 0 0 0 0 0 0 0
2.3341 -0.5238 -0.7268 C 0 0 0 0 0 0 0 0 0 0 0 0
2.6579 0.7412 -0.4913 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.2585 1.7916 0.6383 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.0510 1.9634 1.0801 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.4113 -0.3803 0.5902 H 0 0 0 0 0 0 0 0 0 0 0 0
3.0994 -1.2055 -1.0635 H 0 0 0 0 0 0 0 0 0 0 0 0
3.6578 1.1082 -0.6252 H 0 0 0 0 0 0 0 0 0 0 0 0
1.8658 1.3984 -0.1547 H 0 0 0 0 0 0 0 0 0 0 0 0
1 2 2 3
2 3 1 0
3 4 2 0
3 5 1 0
5 6 1 0
6 7 2 0
6 8 1 0
8 9 2 3
1 10 1 0
1 11 1 0
2 12 1 0
8 13 1 0
9 14 1 0
9 15 1 0
M END
Similar Monomers
Structure
Similarity
IUPAC name
MF
Copolymers