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
-4.3689 -0.4153 1.0034 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.7648 0.5609 0.0797 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.5146 1.4893 -0.4707 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.3527 0.5188 -0.2365 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.8063 1.3345 -1.0185 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.5783 -0.4662 0.3528 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.2256 -0.5237 0.0634 C 0 0 0 0 0 0 0 0 0 0 0 0
0.1738 -1.2928 -1.0079 C 0 0 0 0 0 0 0 0 0 0 0 0
1.5193 -1.3466 -1.2912 C 0 0 0 0 0 0 0 0 0 0 0 0
2.4367 -0.6591 -0.5349 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0585 0.1092 0.5320 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7071 0.1674 0.8220 C 0 0 0 0 0 0 0 0 0 0 0 0
2.9966 0.7862 1.2713 C 0 0 0 0 0 0 0 0 0 0 0 0
4.3422 0.7126 0.9620 C 0 0 0 0 0 0 0 0 0 0 0 0
4.7200 -0.0584 -0.1085 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7863 -0.7386 -0.8525 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.6090 0.0381 2.0088 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.7059 -1.2719 1.2245 H 0 0 0 0 0 0 0 0 0 0 0 0
-5.3472 -0.8080 0.6011 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.1298 2.2338 -1.1564 H 0 0 0 0 0 0 0 0 0 0 0 0
-5.5684 1.5317 -0.2434 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.5439 -1.8312 -1.6002 H 0 0 0 0 0 0 0 0 0 0 0 0
1.8480 -1.9372 -2.1174 H 0 0 0 0 0 0 0 0 0 0 0 0
0.3593 0.7593 1.6530 H 0 0 0 0 0 0 0 0 0 0 0 0
2.6666 1.3852 2.1087 H 0 0 0 0 0 0 0 0 0 0 0 0
5.0749 1.2428 1.5413 H 0 0 0 0 0 0 0 0 0 0 0 0
5.7706 -0.1606 -0.4085 H 0 0 0 0 0 0 0 0 0 0 0 0
4.0555 -1.3600 -1.7098 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