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
-3.6923 1.0290 0.2001 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.3954 0.3966 -0.2813 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.9353 -0.5806 0.7682 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.6607 -1.2618 0.3916 C 0 0 0 0 0 0 0 0 0 0 0 0
0.4101 -0.3631 0.1996 O 0 0 0 0 0 0 0 0 0 0 0 0
1.6492 -0.8998 -0.1559 C 0 0 0 0 0 0 0 0 0 0 0 0
1.7578 -2.1479 -0.2885 O 0 0 0 0 0 0 0 0 0 0 0 0
2.8218 -0.0831 -0.3803 C 0 0 0 0 0 0 0 0 0 0 0 0
3.9814 -0.6226 -0.7161 C 0 0 0 0 0 0 0 0 0 0 0 0
2.7910 1.4032 -0.2471 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.6276 2.1509 0.1810 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.8972 0.7512 1.2513 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.5530 0.7012 -0.4010 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.6105 1.1787 -0.4648 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.5877 -0.0949 -1.2506 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.7208 -1.3553 0.8600 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.8907 -0.0618 1.7429 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.8364 -1.8024 -0.5632 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.3646 -1.9539 1.2061 H 0 0 0 0 0 0 0 0 0 0 0 0
4.0567 -1.7092 -0.8267 H 0 0 0 0 0 0 0 0 0 0 0 0
4.8737 -0.0674 -0.8925 H 0 0 0 0 0 0 0 0 0 0 0 0
1.8617 1.8318 -0.6724 H 0 0 0 0 0 0 0 0 0 0 0 0
2.9406 1.6905 0.8263 H 0 0 0 0 0 0 0 0 0 0 0 0
3.6281 1.8707 -0.8068 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