Monomers
Methacrylic acid
Identifiers
IUPAC name
2-methylprop-2-enoic acid
InchI
InChI=1S/C4H6O2/c1-3(2)4(5)6/h1H2,2H3,(H,5,6)
InchI Key
CERQOIWHTDAKMF-UHFFFAOYSA-N
SMILES
CC(=C)C(=O)O
Canonical SMILES
CC(=C)C(=O)O
Isomeric SMILES
CC(=C)C(=O)O
Structures
2D Structure
3D Structure
Molecular Formula and Computed Descriptors
Molecular Formula
C4H6O2
Heavy Atom Count
6
Molecular Weight
86.09
Exact Molecular Weight
86.0368
Valence Electrons
34
Radical Electrons
0
tPSA
37.3
MolLogP
0.6471
H Bond Acceptors
1
H Bond Donors
1
Aliphatic Carbocycles
0
Aromatic Carbocycles
0
Aliphatic Heterocycles
0
Aromatic Heterocycles
0
Aliphatic Rings
0
Aromatic Rings
0
MOL File
RDKit 3D
12 11 0 0 0 0 0 0 0 0999 V2000
-0.7832 -1.0830 0.4948 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2916 0.1954 -0.0843 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.1078 1.1796 -0.4186 C 0 0 0 0 0 0 0 0 0 0 0 0
1.1271 0.3656 -0.2878 C 0 0 0 0 0 0 0 0 0 0 0 0
1.5824 1.4135 -0.7674 O 0 0 0 0 0 0 0 0 0 0 0 0
1.9945 -0.6485 0.0542 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.8539 -1.8023 -0.3494 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.7164 -0.9615 1.0482 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.0103 -1.4533 1.2080 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.7358 2.0887 -0.8325 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.1766 1.0860 -0.2797 H 0 0 0 0 0 0 0 0 0 0 0 0
2.9716 -0.3803 0.2144 H 0 0 0 0 0 0 0 0 0 0 0 0
1 2 1 0
2 3 2 3
2 4 1 0
4 5 2 0
4 6 1 0
1 7 1 0
1 8 1 0
1 9 1 0
3 10 1 0
3 11 1 0
6 12 1 0
M END
Similar Monomers
Structure
Similarity
IUPAC name
MF
Copolymers