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
4.7377 0.2866 1.1491 C 0 0 0 0 0 0 0 0 0 0 0 0
3.8473 0.0136 -0.0089 C 0 0 0 0 0 0 0 0 0 0 0 0
4.3337 -0.1047 -1.2109 C 0 0 0 0 0 0 0 0 0 0 0 0
2.4215 -0.1156 0.2483 C 0 0 0 0 0 0 0 0 0 0 0 0
1.9335 -0.0044 1.4027 O 0 0 0 0 0 0 0 0 0 0 0 0
1.4994 -0.3716 -0.7683 O 0 0 0 0 0 0 0 0 0 0 0 0
0.1547 -0.4903 -0.5042 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.4623 -1.6829 -0.1927 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7995 -1.7618 0.0635 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.5822 -0.6337 0.0170 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.0004 0.5800 -0.2917 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.6459 0.6339 -0.5468 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.8219 1.6800 -0.3265 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.1757 1.6064 -0.0682 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.7613 0.3925 0.2412 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.9481 -0.7214 0.2798 C 0 0 0 0 0 0 0 0 0 0 0 0
4.9126 1.3576 1.2859 H 0 0 0 0 0 0 0 0 0 0 0 0
4.2905 -0.1635 2.0469 H 0 0 0 0 0 0 0 0 0 0 0 0
5.6971 -0.2670 0.9363 H 0 0 0 0 0 0 0 0 0 0 0 0
3.6544 -0.3031 -2.0266 H 0 0 0 0 0 0 0 0 0 0 0 0
5.4062 -0.0044 -1.3838 H 0 0 0 0 0 0 0 0 0 0 0 0
0.1780 -2.5589 -0.1624 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.2882 -2.7103 0.3109 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.2174 1.5979 -0.7859 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.3583 2.6273 -0.5691 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.7991 2.4944 -0.1035 H 0 0 0 0 0 0 0 0 0 0 0 0
-5.8304 0.3168 0.4480 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.3760 -1.6935 0.5201 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