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
2.4329 0.4246 -1.5365 C 0 0 0 0 0 0 0 0 0 0 0 0
1.6719 -0.5400 -2.0154 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3958 -0.8651 -1.4362 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3067 -1.7917 -1.9170 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.1263 -0.1851 -0.3296 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.3602 -0.5153 0.2135 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.9782 -1.4594 -0.3475 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.9246 0.1734 1.3601 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.3176 1.1646 1.9794 C 0 0 0 0 0 0 0 0 0 0 0 0
3.3816 0.7020 -1.9289 H 0 0 0 0 0 0 0 0 0 0 0 0
2.0733 0.9912 -0.6691 H 0 0 0 0 0 0 0 0 0 0 0 0
2.0263 -1.0962 -2.8677 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.8852 -0.1387 1.7239 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.7417 1.6740 2.8323 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.3412 1.4616 1.5880 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