Monomers
Butyl methacrylate
Identifiers
IUPAC name
butyl 2-methylprop-2-enoate
InchI
InChI=1S/C8H14O2/c1-4-5-6-10-8(9)7(2)3/h2,4-6H2,1,3H3
InchI Key
SOGAXMICEFXMKE-UHFFFAOYSA-N
SMILES
CCCCOC(=O)C(=C)C
Canonical SMILES
CCCCOC(=O)C(=C)C
Isomeric SMILES
CCCCOC(=O)C(=C)C
Structures
2D Structure
3D Structure
Molecular Formula and Computed Descriptors
Molecular Formula
C8H14O2
Heavy Atom Count
10
Molecular Weight
142.198
Exact Molecular Weight
142.0994
Valence Electrons
58
Radical Electrons
0
tPSA
26.3
MolLogP
1.9058
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
24 23 0 0 0 0 0 0 0 0999 V2000
2.6478 0.3710 -1.4587 C 0 0 0 0 0 0 0 0 0 0 0 0
2.2910 1.1779 -0.2546 C 0 0 0 0 0 0 0 0 0 0 0 0
2.1588 0.3272 0.9888 C 0 0 0 0 0 0 0 0 0 0 0 0
1.1032 -0.7217 0.8617 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.1807 -0.1743 0.6217 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.2956 -0.9892 0.4735 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.0840 -2.2293 0.5667 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.6275 -0.4533 0.2260 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.6268 -1.3009 0.0985 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.8913 0.9927 0.1147 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0865 -0.5613 -1.5794 H 0 0 0 0 0 0 0 0 0 0 0 0
2.4678 0.9723 -2.3785 H 0 0 0 0 0 0 0 0 0 0 0 0
3.7381 0.1436 -1.4594 H 0 0 0 0 0 0 0 0 0 0 0 0
3.1121 1.9003 -0.0673 H 0 0 0 0 0 0 0 0 0 0 0 0
1.3782 1.7808 -0.4100 H 0 0 0 0 0 0 0 0 0 0 0 0
3.1361 -0.2032 1.1092 H 0 0 0 0 0 0 0 0 0 0 0 0
2.0588 0.9697 1.8851 H 0 0 0 0 0 0 0 0 0 0 0 0
1.0347 -1.2398 1.8491 H 0 0 0 0 0 0 0 0 0 0 0 0
1.4155 -1.4609 0.1231 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.6495 -0.9885 -0.0869 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.4868 -2.3813 0.1722 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.3962 1.5187 0.9758 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.9728 1.1932 0.1578 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.4172 1.3564 -0.8183 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 1 0
5 6 1 0
6 7 2 0
6 8 1 0
8 9 2 3
8 10 1 0
1 11 1 0
1 12 1 0
1 13 1 0
2 14 1 0
2 15 1 0
3 16 1 0
3 17 1 0
4 18 1 0
4 19 1 0
9 20 1 0
9 21 1 0
10 22 1 0
10 23 1 0
10 24 1 0
M END
Similar Monomers
Structure
Similarity
IUPAC name
MF
Copolymers