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
-2.8014 0.9645 0.4099 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.1789 -0.1932 1.1506 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.8593 -1.3635 0.3020 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.9140 -1.2218 -0.8209 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3929 -0.8680 -0.5921 O 0 0 0 0 0 0 0 0 0 0 0 0
1.0119 0.2265 -0.1313 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3398 1.2285 0.1874 O 0 0 0 0 0 0 0 0 0 0 0 0
2.4734 0.3452 0.0349 C 0 0 0 0 0 0 0 0 0 0 0 0
3.2621 -0.6655 -0.2774 C 0 0 0 0 0 0 0 0 0 0 0 0
3.0995 1.5830 0.5500 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.7528 1.8672 1.0471 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.8947 0.7531 0.2544 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.2983 1.1965 -0.5494 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.0339 -0.5632 1.8314 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.3604 0.0593 1.8178 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.4111 -2.1508 0.9969 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.8150 -1.8899 -0.0248 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.8658 -2.2390 -1.3404 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.3780 -0.5706 -1.6549 H 0 0 0 0 0 0 0 0 0 0 0 0
4.3346 -0.6144 -0.1689 H 0 0 0 0 0 0 0 0 0 0 0 0
2.8611 -1.5967 -0.6590 H 0 0 0 0 0 0 0 0 0 0 0 0
3.7907 1.3505 1.4068 H 0 0 0 0 0 0 0 0 0 0 0 0
3.6881 2.1177 -0.2362 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3095 2.2447 0.9532 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