Monomers
2-Naphthyl methacrylate
Identifiers
IUPAC name
naphthalen-2-yl 2-methylprop-2-enoate
InchI
InChI=1S/C14H12O2/c1-10(2)14(15)16-13-8-7-11-5-3-4-6-12(11)9-13/h3-9H,1H2,2H3
InchI Key
CXOYJPWMGYDJNW-UHFFFAOYSA-N
SMILES
CC(=C)C(=O)Oc1ccc2c(c1)cccc2
Canonical SMILES
CC(=C)C(=O)OC1=CC2=CC=CC=C2C=C1
Isomeric SMILES
CC(=C)C(=O)OC1=CC2=CC=CC=C2C=C1
Structures
2D Structure
3D Structure
Molecular Formula and Computed Descriptors
Molecular Formula
C14H12O2
Heavy Atom Count
16
Molecular Weight
212.248
Exact Molecular Weight
212.0837
Valence Electrons
80
Radical Electrons
0
tPSA
26.3
MolLogP
3.3213
H Bond Acceptors
2
H Bond Donors
0
Aliphatic Carbocycles
0
Aromatic Carbocycles
2
Aliphatic Heterocycles
0
Aromatic Heterocycles
0
Aliphatic Rings
0
Aromatic Rings
2
MOL File
RDKit 3D
28 29 0 0 0 0 0 0 0 0999 V2000
4.4593 0.5978 -0.8837 C 0 0 0 0 0 0 0 0 0 0 0 0
3.8651 -0.1028 0.2794 C 0 0 0 0 0 0 0 0 0 0 0 0
4.6351 -0.7132 1.1468 C 0 0 0 0 0 0 0 0 0 0 0 0
2.4284 -0.1230 0.4739 C 0 0 0 0 0 0 0 0 0 0 0 0
1.9163 -0.7149 1.4578 O 0 0 0 0 0 0 0 0 0 0 0 0
1.5398 0.5006 -0.4006 O 0 0 0 0 0 0 0 0 0 0 0 0
0.1636 0.4748 -0.2043 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3751 1.5047 0.5488 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7598 1.5057 0.7639 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.5618 0.5230 0.2490 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.0197 -0.5009 -0.5006 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.6574 -0.5054 -0.7145 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.8683 -1.4567 -0.9907 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.2359 -1.4323 -0.7632 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.7760 -0.4080 -0.0134 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.9169 0.5733 0.4916 C 0 0 0 0 0 0 0 0 0 0 0 0
5.5274 0.8344 -0.6312 H 0 0 0 0 0 0 0 0 0 0 0 0
4.4285 -0.0660 -1.7756 H 0 0 0 0 0 0 0 0 0 0 0 0
3.9561 1.5723 -1.0897 H 0 0 0 0 0 0 0 0 0 0 0 0
5.7121 -0.7385 1.0641 H 0 0 0 0 0 0 0 0 0 0 0 0
4.1930 -1.2194 1.9885 H 0 0 0 0 0 0 0 0 0 0 0 0
0.2569 2.2880 0.9603 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.1439 2.3297 1.3592 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.2279 -1.3019 -1.2989 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.4483 -2.2613 -1.5790 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.9194 -2.1790 -1.1429 H 0 0 0 0 0 0 0 0 0 0 0 0
-5.8492 -0.3687 0.1782 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.3221 1.3878 1.0840 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
6 7 1 0
7 8 2 0
8 9 1 0
9 10 2 0
10 11 1 0
11 12 2 0
11 13 1 0
13 14 2 0
14 15 1 0
15 16 2 0
12 7 1 0
16 10 1 0
1 17 1 0
1 18 1 0
1 19 1 0
3 20 1 0
3 21 1 0
8 22 1 0
9 23 1 0
12 24 1 0
13 25 1 0
14 26 1 0
15 27 1 0
16 28 1 0
M END
Similar Monomers
Structure
Similarity
IUPAC name
MF
Copolymers