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
4.5105 0.4186 -0.6856 C 0 0 0 0 0 0 0 0 0 0 0 0
3.8213 -0.4688 0.2815 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5292 -1.3360 0.9816 C 0 0 0 0 0 0 0 0 0 0 0 0
2.3777 -0.4004 0.4723 C 0 0 0 0 0 0 0 0 0 0 0 0
1.7817 -1.1526 1.2941 O 0 0 0 0 0 0 0 0 0 0 0 0
1.5802 0.4936 -0.2375 O 0 0 0 0 0 0 0 0 0 0 0 0
0.2098 0.5227 -0.0222 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2595 1.3749 0.9569 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.6201 1.4321 1.2012 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.5184 0.6632 0.4952 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.0320 -0.1823 -0.4790 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.6772 -0.2552 -0.7393 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.9414 -0.9616 -1.1946 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.2886 -0.8801 -0.9261 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.7977 -0.0416 0.0436 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.8865 0.7230 0.7432 C 0 0 0 0 0 0 0 0 0 0 0 0
4.9408 1.2636 -0.0825 H 0 0 0 0 0 0 0 0 0 0 0 0
3.7806 0.8699 -1.4041 H 0 0 0 0 0 0 0 0 0 0 0 0
5.2997 -0.1080 -1.2406 H 0 0 0 0 0 0 0 0 0 0 0 0
5.6004 -1.4401 0.8908 H 0 0 0 0 0 0 0 0 0 0 0 0
4.0555 -2.0023 1.7000 H 0 0 0 0 0 0 0 0 0 0 0 0
0.4292 1.9892 1.5248 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.9942 2.1003 1.9696 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.2955 -0.9056 -1.4897 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.5221 -1.6112 -1.9492 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.9795 -1.4905 -1.4895 H 0 0 0 0 0 0 0 0 0 0 0 0
-5.8645 -0.0051 0.2261 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.2395 1.3904 1.5080 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