Monomers
2-Methylprop-2-enoate;trimethylstannanylium
Identifiers
IUPAC name
2-methylprop-2-enoate;trimethylstannanylium
InchI
InChI=1S/C4H6O2.3CH3.Sn/c1-3(2)4(5)6;;;;/h1H2,2H3,(H,5,6);3*1H3;/q;;;;+1/p-1
InchI Key
SDPSJISXAJHWOB-UHFFFAOYSA-M
SMILES
CC(=C)C(=O)[O-].C[Sn+](C)C
Canonical SMILES
CC(=C)C(=O)[O-].C[Sn+](C)C
Isomeric SMILES
CC(=C)C(=O)[O-].C[Sn+](C)C
Structures
2D Structure
3D Structure
Molecular Formula and Computed Descriptors
Molecular Formula
C7H14O2Sn
Heavy Atom Count
10
Molecular Weight
248.898
Exact Molecular Weight
250.0016
Valence Electrons
58
Radical Electrons
0
tPSA
40.13
MolLogP
0.683
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 22 0 0 0 0 0 0 0 0999 V2000
-0.5074 -1.2307 -0.1031 C 0 0 0 0 0 0 0 0 0 0 0 0
0.0912 0.1175 0.0345 C 0 0 0 0 0 0 0 0 0 0 0 0
1.2038 0.2964 0.7135 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.5456 1.2461 -0.5778 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.5978 1.1098 -1.2260 O 0 0 0 0 0 0 0 0 0 0 0 0
0.0077 2.4958 -0.4512 O 0 0 0 0 0 1 0 0 0 0 0 0
-0.8186 1.9455 0.1917 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0370 -0.0479 0.4844 Sn 0 0 0 0 0 3 0 0 0 0 0 0
2.0759 -0.3154 0.1602 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.3050 -1.6443 -0.2609 C 0 0 0 0 0 0 0 0 0 0 0 0
0.0470 -1.9734 0.4977 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.5141 -1.5435 -1.1543 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.5588 -1.2603 0.2488 H 0 0 0 0 0 0 0 0 0 0 0 0
1.6509 1.2813 0.8203 H 0 0 0 0 0 0 0 0 0 0 0 0
1.7231 -0.5391 1.1976 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.4002 2.6450 0.9547 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.9116 1.9571 0.1653 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.4408 2.2626 -0.8187 H 0 0 0 0 0 0 0 0 0 0 0 0
2.2675 -0.9007 -0.7703 H 0 0 0 0 0 0 0 0 0 0 0 0
2.6136 0.6304 0.0956 H 0 0 0 0 0 0 0 0 0 0 0 0
2.4542 -0.8971 1.0307 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.3233 -1.5002 0.1633 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.8696 -2.6289 -0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.3051 -1.5062 -1.3770 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
8 10 1 0
1 11 1 0
1 12 1 0
1 13 1 0
3 14 1 0
3 15 1 0
7 16 1 0
7 17 1 0
7 18 1 0
9 19 1 0
9 20 1 0
9 21 1 0
10 22 1 0
10 23 1 0
10 24 1 0
M CHG 2 6 -1 8 1
M END
Similar Monomers
Structure
Similarity
IUPAC name
MF
Copolymers