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
3.2555 -0.6852 -0.9223 C 0 0 0 0 0 0 0 0 0 0 0 0
3.0658 0.4971 -0.0071 C 0 0 0 0 0 0 0 0 0 0 0 0
1.5769 0.7899 0.1960 C 0 0 0 0 0 0 0 0 0 0 0 0
0.9734 -0.4513 0.8094 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3955 -0.3457 1.0602 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.3743 -0.1103 0.1170 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.9664 0.0191 -1.0875 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.7767 -0.0119 0.4439 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.1644 -0.1468 1.6723 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.7551 0.2411 -0.6235 C 0 0 0 0 0 0 0 0 0 0 0 0
3.2587 -1.6032 -0.3029 H 0 0 0 0 0 0 0 0 0 0 0 0
4.1943 -0.5664 -1.5125 H 0 0 0 0 0 0 0 0 0 0 0 0
2.4111 -0.7018 -1.6567 H 0 0 0 0 0 0 0 0 0 0 0 0
3.5859 1.3977 -0.3917 H 0 0 0 0 0 0 0 0 0 0 0 0
3.5489 0.2454 0.9587 H 0 0 0 0 0 0 0 0 0 0 0 0
1.0892 1.0717 -0.7349 H 0 0 0 0 0 0 0 0 0 0 0 0
1.5091 1.5870 0.9818 H 0 0 0 0 0 0 0 0 0 0 0 0
1.4734 -0.5629 1.8175 H 0 0 0 0 0 0 0 0 0 0 0 0
1.2558 -1.3667 0.2543 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.4484 -0.3319 2.4528 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.2010 -0.0757 1.9247 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.6017 -0.4743 -0.6140 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.2218 1.2507 -0.4248 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.2928 0.3347 -1.6256 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