Monomers
Ethyl methacrylate
Identifiers
IUPAC name
ethyl 2-methylprop-2-enoate
InchI
InChI=1S/C6H10O2/c1-4-8-6(7)5(2)3/h2,4H2,1,3H3
InchI Key
SUPCQIBBMFXVTL-UHFFFAOYSA-N
SMILES
CCOC(=O)C(=C)C
Canonical SMILES
CCOC(=O)C(=C)C
Isomeric SMILES
CCOC(=O)C(=C)C
Structures
2D Structure
3D Structure
Molecular Formula and Computed Descriptors
Molecular Formula
C6H10O2
Heavy Atom Count
8
Molecular Weight
114.144
Exact Molecular Weight
114.0681
Valence Electrons
46
Radical Electrons
0
tPSA
26.3
MolLogP
1.1256
H Bond Acceptors
2
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
2.7599 0.0474 -0.0209 C 0 0 0 0 0 0 0 0 0 0 0 0
1.8157 -0.0366 -1.1793 C 0 0 0 0 0 0 0 0 0 0 0 0
0.4753 0.2418 -0.8017 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.1976 -0.5142 0.1400 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3942 -1.4814 0.6823 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.5676 -0.1526 0.4611 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.2475 -0.8439 1.3518 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.2161 0.9990 -0.2102 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8881 -0.9091 0.4947 H 0 0 0 0 0 0 0 0 0 0 0 0
3.7661 0.4166 -0.3021 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3431 0.7946 0.6963 H 0 0 0 0 0 0 0 0 0 0 0 0
2.1067 0.7396 -1.9165 H 0 0 0 0 0 0 0 0 0 0 0 0
1.8761 -1.0196 -1.7079 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.7619 -1.6785 1.8312 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.2602 -0.5502 1.5670 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.3027 1.0160 -0.0127 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.8212 1.9620 0.2149 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.0504 0.9691 -1.2879 H 0 0 0 0 0 0 0 0 0 0 0 0
1 2 1 0
2 3 1 0
3 4 1 0
4 5 2 0
4 6 1 0
6 7 2 3
6 8 1 0
1 9 1 0
1 10 1 0
1 11 1 0
2 12 1 0
2 13 1 0
7 14 1 0
7 15 1 0
8 16 1 0
8 17 1 0
8 18 1 0
M END
Similar Monomers
Structure
Similarity
IUPAC name
MF
Copolymers