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
-1.6651 -0.5309 -1.1857 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.5049 0.5375 -0.5606 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.8957 1.1502 0.6748 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.5836 1.7980 0.4394 C 0 0 0 0 0 0 0 0 0 0 0 0
0.4491 0.9939 -0.0295 O 0 0 0 0 0 0 0 0 0 0 0 0
0.9607 -0.1071 0.6448 C 0 0 0 0 0 0 0 0 0 0 0 0
0.4581 -0.3871 1.7395 O 0 0 0 0 0 0 0 0 0 0 0 0
2.0413 -0.9244 0.1230 C 0 0 0 0 0 0 0 0 0 0 0 0
2.4947 -1.9516 0.7870 C 0 0 0 0 0 0 0 0 0 0 0 0
2.6327 -0.5803 -1.1839 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.2792 -1.0188 -1.9927 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.7575 -0.1412 -1.6764 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.3934 -1.3394 -0.4791 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.5104 0.1062 -0.3579 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.6951 1.3500 -1.3127 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.6105 1.9408 1.0128 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.8844 0.3608 1.4510 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.7550 2.5834 -0.3582 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.2801 2.4193 1.3323 H 0 0 0 0 0 0 0 0 0 0 0 0
2.0530 -2.1946 1.7452 H 0 0 0 0 0 0 0 0 0 0 0 0
3.3105 -2.5657 0.3893 H 0 0 0 0 0 0 0 0 0 0 0 0
3.7448 -0.6393 -1.1898 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3776 0.4574 -1.5098 H 0 0 0 0 0 0 0 0 0 0 0 0
2.2923 -1.3171 -1.9501 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