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
3.6094 0.1840 -0.2265 C 0 0 0 0 0 0 0 0 0 0 0 0
2.4828 -0.4090 0.0834 C 0 0 0 0 0 0 0 0 0 0 0 0
1.2202 0.1653 -0.3692 C 0 0 0 0 0 0 0 0 0 0 0 0
1.1667 1.2203 -1.0539 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.0068 -0.4272 -0.0661 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.2124 0.1135 -0.4933 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.2172 1.1821 -1.1837 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.4779 -0.5297 -0.1599 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.6164 -0.0126 -0.5676 C 0 0 0 0 0 0 0 0 0 0 0 0
3.6380 1.0895 -0.8093 H 0 0 0 0 0 0 0 0 0 0 0 0
4.5401 -0.2371 0.1057 H 0 0 0 0 0 0 0 0 0 0 0 0
2.5111 -1.3114 0.6679 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.4715 -1.4309 0.4225 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.6169 0.8913 -1.1513 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.5493 -0.4881 -0.3209 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