Monomers
Tributyl tin methacrylate
Identifiers
IUPAC name
2-methylprop-2-enoate;tributylstannanylium
InchI
InChI=1S/C4H6O2.3C4H9.Sn/c1-3(2)4(5)6;3*1-3-4-2;/h1H2,2H3,(H,5,6);3*1,3-4H2,2H3;/q;;;;+1/p-1
InchI Key
LPUCKLOWOWADAC-UHFFFAOYSA-M
SMILES
CC(=C)C(=O)[O-].CCCC[Sn+](CCCC)CCCC
Canonical SMILES
CCCC[Sn+](CCCC)CCCC.CC(=C)C(=O)[O-]
Isomeric SMILES
CCCC[Sn+](CCCC)CCCC.CC(=C)C(=O)[O-]
Structures
2D Structure
3D Structure
Molecular Formula and Computed Descriptors
Molecular Formula
C16H32O2Sn
Heavy Atom Count
19
Molecular Weight
375.141
Exact Molecular Weight
376.1424
Valence Electrons
112
Radical Electrons
0
tPSA
40.13
MolLogP
4.1939
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
51 49 0 0 0 0 0 0 0 0999 V2000
1.2707 0.0399 0.3719 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.1361 -0.0458 -0.0794 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.5320 -1.0384 -0.8260 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.0850 0.9801 0.3093 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.6862 1.9296 1.0290 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.3945 0.9024 -0.1095 O 0 0 0 0 0 1 0 0 0 0 0 0
-2.8762 -3.3475 0.7622 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.2915 -2.1968 -0.0296 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.3404 -2.7098 -1.0922 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.7357 -1.6156 -1.9016 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3918 -0.2252 -0.7670 Sn 0 0 0 0 0 3 0 0 0 0 0 0
1.2328 -0.7037 1.1514 C 0 0 0 0 0 0 0 0 0 0 0 0
2.4857 0.1296 1.3107 C 0 0 0 0 0 0 0 0 0 0 0 0
3.4810 -0.1939 0.2057 C 0 0 0 0 0 0 0 0 0 0 0 0
3.8449 -1.6422 0.2760 C 0 0 0 0 0 0 0 0 0 0 0 0
0.1894 1.8804 -1.2262 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.7565 2.4506 -0.1845 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.9952 3.9157 -0.3761 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.9428 4.3798 0.7044 C 0 0 0 0 0 0 0 0 0 0 0 0
1.9901 0.0700 -0.4553 H 0 0 0 0 0 0 0 0 0 0 0 0
1.5035 -0.8584 1.0134 H 0 0 0 0 0 0 0 0 0 0 0 0
1.4555 0.9207 1.0158 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.5449 -1.1020 -1.1521 H 0 0 0 0 0 0 0 0 0 0 0 0
0.1588 -1.7981 -1.1171 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.9693 -3.4711 0.5566 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.7482 -3.2070 1.8556 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.3917 -4.2884 0.4525 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.6747 -1.5985 0.6880 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.0871 -1.5949 -0.4650 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.9684 -3.3242 -1.7882 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.5949 -3.4163 -0.6743 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.0610 -2.0814 -2.6500 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.5516 -1.1132 -2.4620 H 0 0 0 0 0 0 0 0 0 0 0 0
0.5168 -0.3361 1.9357 H 0 0 0 0 0 0 0 0 0 0 0 0
1.4749 -1.7593 1.2537 H 0 0 0 0 0 0 0 0 0 0 0 0
2.2640 1.2130 1.2221 H 0 0 0 0 0 0 0 0 0 0 0 0
2.9453 -0.0225 2.3073 H 0 0 0 0 0 0 0 0 0 0 0 0
2.9968 0.0868 -0.7532 H 0 0 0 0 0 0 0 0 0 0 0 0
4.3833 0.4438 0.2916 H 0 0 0 0 0 0 0 0 0 0 0 0
4.9446 -1.7422 0.2609 H 0 0 0 0 0 0 0 0 0 0 0 0
3.3735 -2.1747 -0.5956 H 0 0 0 0 0 0 0 0 0 0 0 0
3.4904 -2.1194 1.2230 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.1977 2.0289 -2.2345 H 0 0 0 0 0 0 0 0 0 0 0 0
1.1794 2.3751 -1.0871 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.7124 1.9152 -0.2981 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.3825 2.2347 0.8283 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.4279 4.0605 -1.3824 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.0481 4.4606 -0.3372 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.3873 5.3590 0.5156 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.3579 4.3789 1.6697 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.6957 3.5713 0.8341 H 0 0 0 0 0 0 0 0 0 0 0 0
1 2 1 0
2 3 2 3
2 4 1 0
4 5 2 0
4 6 1 0
7 8 1 0
8 9 1 0
9 10 1 0
10 11 1 0
11 12 1 0
12 13 1 0
13 14 1 0
14 15 1 0
11 16 1 0
16 17 1 0
17 18 1 0
18 19 1 0
1 20 1 0
1 21 1 0
1 22 1 0
3 23 1 0
3 24 1 0
7 25 1 0
7 26 1 0
7 27 1 0
8 28 1 0
8 29 1 0
9 30 1 0
9 31 1 0
10 32 1 0
10 33 1 0
12 34 1 0
12 35 1 0
13 36 1 0
13 37 1 0
14 38 1 0
14 39 1 0
15 40 1 0
15 41 1 0
15 42 1 0
16 43 1 0
16 44 1 0
17 45 1 0
17 46 1 0
18 47 1 0
18 48 1 0
19 49 1 0
19 50 1 0
19 51 1 0
M CHG 2 6 -1 11 1
M END
Similar Monomers
Structure
Similarity
IUPAC name
MF
Copolymers