Monomers
Decyl methacrylate
Identifiers
IUPAC name
decyl 2-methylprop-2-enoate
InchI
InChI=1S/C14H26O2/c1-4-5-6-7-8-9-10-11-12-16-14(15)13(2)3/h2,4-12H2,1,3H3
InchI Key
GTBGXKPAKVYEKJ-UHFFFAOYSA-N
SMILES
CCCCCCCCCCOC(=O)C(=C)C
Canonical SMILES
CCCCCCCCCCOC(=O)C(=C)C
Isomeric SMILES
CCCCCCCCCCOC(=O)C(=C)C
Structures
2D Structure
3D Structure
Molecular Formula and Computed Descriptors
Molecular Formula
C14H26O2
Heavy Atom Count
16
Molecular Weight
226.36
Exact Molecular Weight
226.1933
Valence Electrons
94
Radical Electrons
0
tPSA
26.3
MolLogP
4.2464
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
42 41 0 0 0 0 0 0 0 0999 V2000
-5.7137 -0.8991 -0.8955 C 0 0 0 0 0 0 0 0 0 0 0 0
-5.7542 0.3475 -0.0912 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.5989 1.2697 -0.2038 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.2652 0.7759 0.2170 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.7153 -0.4024 -0.4863 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.3248 -0.7810 0.0614 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3652 0.3304 -0.1188 C 0 0 0 0 0 0 0 0 0 0 0 0
1.0348 -0.0433 0.4237 C 0 0 0 0 0 0 0 0 0 0 0 0
1.5658 -1.1974 -0.3109 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8898 -1.7521 0.0551 C 0 0 0 0 0 0 0 0 0 0 0 0
4.0069 -0.9489 -0.0014 O 0 0 0 0 0 0 0 0 0 0 0 0
4.3136 0.0770 0.8199 C 0 0 0 0 0 0 0 0 0 0 0 0
3.6094 0.4315 1.7807 O 0 0 0 0 0 0 0 0 0 0 0 0
5.5484 0.8683 0.6192 C 0 0 0 0 0 0 0 0 0 0 0 0
5.8753 1.8721 1.4004 C 0 0 0 0 0 0 0 0 0 0 0 0
6.4246 0.4923 -0.5077 C 0 0 0 0 0 0 0 0 0 0 0 0
-5.6161 -1.7961 -0.2453 H 0 0 0 0 0 0 0 0 0 0 0 0
-6.7495 -1.0419 -1.3519 H 0 0 0 0 0 0 0 0 0 0 0 0
-5.0487 -0.8733 -1.7628 H 0 0 0 0 0 0 0 0 0 0 0 0
-6.6719 0.9369 -0.3650 H 0 0 0 0 0 0 0 0 0 0 0 0
-5.9244 0.0780 0.9789 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.8387 2.1466 0.4779 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.5177 1.7295 -1.2205 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.2173 0.6012 1.3147 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.5536 1.6450 0.0418 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.5892 -0.2969 -1.5634 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.3215 -1.3315 -0.2461 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.5074 -0.8930 1.1703 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.0414 -1.7583 -0.3226 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.2592 0.5678 -1.1866 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.6922 1.2418 0.4563 H 0 0 0 0 0 0 0 0 0 0 0 0
1.6185 0.9004 0.2280 H 0 0 0 0 0 0 0 0 0 0 0 0
0.9805 -0.1602 1.5170 H 0 0 0 0 0 0 0 0 0 0 0 0
1.5971 -0.9072 -1.4114 H 0 0 0 0 0 0 0 0 0 0 0 0
0.8466 -2.0684 -0.2501 H 0 0 0 0 0 0 0 0 0 0 0 0
2.8806 -2.2124 1.0909 H 0 0 0 0 0 0 0 0 0 0 0 0
3.1374 -2.6662 -0.5852 H 0 0 0 0 0 0 0 0 0 0 0 0
5.2316 2.1371 2.2165 H 0 0 0 0 0 0 0 0 0 0 0 0
6.7789 2.4130 1.2134 H 0 0 0 0 0 0 0 0 0 0 0 0
7.3550 1.0824 -0.5020 H 0 0 0 0 0 0 0 0 0 0 0 0
5.9093 0.6676 -1.4787 H 0 0 0 0 0 0 0 0 0 0 0 0
6.6821 -0.5821 -0.3834 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 1 0
7 8 1 0
8 9 1 0
9 10 1 0
10 11 1 0
11 12 1 0
12 13 2 0
12 14 1 0
14 15 2 3
14 16 1 0
1 17 1 0
1 18 1 0
1 19 1 0
2 20 1 0
2 21 1 0
3 22 1 0
3 23 1 0
4 24 1 0
4 25 1 0
5 26 1 0
5 27 1 0
6 28 1 0
6 29 1 0
7 30 1 0
7 31 1 0
8 32 1 0
8 33 1 0
9 34 1 0
9 35 1 0
10 36 1 0
10 37 1 0
15 38 1 0
15 39 1 0
16 40 1 0
16 41 1 0
16 42 1 0
M END
Similar Monomers
Structure
Similarity
IUPAC name
MF
Copolymers