Monomers
Naphthyl methacrylate
Identifiers
IUPAC name
naphthalen-1-yl 2-methylprop-2-enoate
InchI
InChI=1S/C14H12O2/c1-10(2)14(15)16-13-9-5-7-11-6-3-4-8-12(11)13/h3-9H,1H2,2H3
InchI Key
HVYCQBKSRWZZGX-UHFFFAOYSA-N
SMILES
CC(=C)C(=O)Oc1cccc2c1cccc2
Canonical SMILES
CC(=C)C(=O)OC1=CC=CC2=CC=CC=C21
Isomeric SMILES
CC(=C)C(=O)OC1=CC=CC2=CC=CC=C21
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
4.1453 0.7262 0.9842 C 0 0 0 0 0 0 0 0 0 0 0 0
3.2312 0.3231 -0.1065 C 0 0 0 0 0 0 0 0 0 0 0 0
3.6630 0.3492 -1.3444 C 0 0 0 0 0 0 0 0 0 0 0 0
1.8726 -0.0963 0.1879 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4337 -0.1289 1.3811 O 0 0 0 0 0 0 0 0 0 0 0 0
0.9734 -0.4841 -0.7926 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.3320 -0.8845 -0.4821 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.5419 -2.2171 -0.2337 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7932 -2.7013 0.0796 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.8526 -1.8191 0.1427 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.6241 -0.4640 -0.1127 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.3675 0.0022 -0.4243 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.1035 1.3308 -0.6823 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.1577 2.2147 -0.6205 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.4035 1.7703 -0.3144 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.6655 0.4323 -0.0552 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7539 0.3327 1.9217 H 0 0 0 0 0 0 0 0 0 0 0 0
4.3413 1.8181 1.0062 H 0 0 0 0 0 0 0 0 0 0 0 0
5.1549 0.2441 0.8404 H 0 0 0 0 0 0 0 0 0 0 0 0
2.9758 0.0477 -2.1488 H 0 0 0 0 0 0 0 0 0 0 0 0
4.6684 0.6601 -1.5569 H 0 0 0 0 0 0 0 0 0 0 0 0
0.2872 -2.9203 -0.2811 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.9133 -3.7722 0.2700 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.8341 -2.2016 0.3889 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.0895 1.6410 -0.9234 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.9478 3.2730 -0.8259 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.2269 2.4461 -0.2638 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.6477 0.0778 0.1867 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
12 13 1 0
13 14 2 0
14 15 1 0
15 16 2 0
12 7 1 0
16 11 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
10 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