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
-4.5249 -0.6466 0.2886 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.7923 0.6197 0.1100 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.4453 1.7538 0.1982 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.3725 0.6168 -0.1589 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7874 1.7156 -0.3043 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.6075 -0.5354 -0.2677 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.2466 -0.4596 -0.5279 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2437 -0.4561 -1.8156 C 0 0 0 0 0 0 0 0 0 0 0 0
1.5987 -0.3798 -2.0368 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5317 -0.3041 -1.0241 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0251 -0.3086 0.2667 C 0 0 0 0 0 0 0 0 0 0 0 0
0.6664 -0.3848 0.5009 C 0 0 0 0 0 0 0 0 0 0 0 0
2.9386 -0.2336 1.3032 C 0 0 0 0 0 0 0 0 0 0 0 0
4.2950 -0.1575 1.0695 C 0 0 0 0 0 0 0 0 0 0 0 0
4.7713 -0.1550 -0.2256 C 0 0 0 0 0 0 0 0 0 0 0 0
3.8873 -0.2286 -1.2813 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.9296 -0.7404 1.3326 H 0 0 0 0 0 0 0 0 0 0 0 0
-5.3622 -0.7408 -0.4341 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.8820 -1.5367 0.1460 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.9839 2.7267 0.0802 H 0 0 0 0 0 0 0 0 0 0 0 0
-5.5072 1.7695 0.3988 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.4513 -0.5144 -2.6703 H 0 0 0 0 0 0 0 0 0 0 0 0
1.9845 -0.3770 -3.0523 H 0 0 0 0 0 0 0 0 0 0 0 0
0.3068 -0.3858 1.5287 H 0 0 0 0 0 0 0 0 0 0 0 0
2.5679 -0.2356 2.3137 H 0 0 0 0 0 0 0 0 0 0 0 0
4.9713 -0.1002 1.9306 H 0 0 0 0 0 0 0 0 0 0 0 0
5.8440 -0.0947 -0.4064 H 0 0 0 0 0 0 0 0 0 0 0 0
4.2603 -0.2268 -2.3083 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