Monomers
Methyl 2-ethylacrylate
Identifiers
IUPAC name
methyl 2-methylidenebutanoate
InchI
InChI=1S/C6H10O2/c1-4-5(2)6(7)8-3/h2,4H2,1,3H3
InchI Key
JKJJSJJGBZXUQV-UHFFFAOYSA-N
SMILES
CCC(=C)C(=O)OC
Canonical SMILES
CCC(=C)C(=O)OC
Isomeric SMILES
CCC(=C)C(=O)OC
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
-2.6251 -0.4618 -0.1668 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.1532 -0.7221 -0.0073 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3850 0.5360 -0.0453 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.0306 1.6698 -0.2040 C 0 0 0 0 0 0 0 0 0 0 0 0
1.0762 0.5225 0.0919 C 0 0 0 0 0 0 0 0 0 0 0 0
1.7256 1.5919 0.0593 O 0 0 0 0 0 0 0 0 0 0 0 0
1.7864 -0.6517 0.2602 O 0 0 0 0 0 0 0 0 0 0 0 0
3.1989 -0.6621 0.3925 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.0553 0.1244 0.6605 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.1538 -1.4580 -0.1301 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.8374 -0.0516 -1.1604 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.8392 -1.3076 -0.9201 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.9244 -1.3540 0.8641 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.4546 2.5830 -0.2298 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.1012 1.6488 -0.3019 H 0 0 0 0 0 0 0 0 0 0 0 0
3.6869 0.1350 -0.1927 H 0 0 0 0 0 0 0 0 0 0 0 0
3.5849 -1.6459 0.0903 H 0 0 0 0 0 0 0 0 0 0 0 0
3.5010 -0.4965 1.4555 H 0 0 0 0 0 0 0 0 0 0 0 0
1 2 1 0
2 3 1 0
3 4 2 3
3 5 1 0
5 6 2 0
5 7 1 0
7 8 1 0
1 9 1 0
1 10 1 0
1 11 1 0
2 12 1 0
2 13 1 0
4 14 1 0
4 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