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
4.4709 -0.9742 -0.1802 C 0 0 0 0 0 0 0 0 0 0 0 0
3.8429 0.3321 -0.5306 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5685 1.3318 -0.9829 C 0 0 0 0 0 0 0 0 0 0 0 0
2.4073 0.5107 -0.3722 C 0 0 0 0 0 0 0 0 0 0 0 0
1.8954 1.6173 -0.6720 O 0 0 0 0 0 0 0 0 0 0 0 0
1.5588 -0.4663 0.0912 O 0 0 0 0 0 0 0 0 0 0 0 0
0.1890 -0.2976 0.2429 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2157 0.1803 1.4952 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.5675 0.3606 1.6839 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.5055 0.0969 0.7182 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.0603 -0.3700 -0.4934 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.7195 -0.5713 -0.7440 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.0233 -0.6301 -1.4550 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.3639 -0.4415 -1.2401 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.8015 0.0288 -0.0170 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.8511 0.2911 0.9477 C 0 0 0 0 0 0 0 0 0 0 0 0
5.5328 -0.7758 0.1022 H 0 0 0 0 0 0 0 0 0 0 0 0
4.4657 -1.6918 -1.0075 H 0 0 0 0 0 0 0 0 0 0 0 0
3.9997 -1.3862 0.7560 H 0 0 0 0 0 0 0 0 0 0 0 0
5.6292 1.1854 -1.0950 H 0 0 0 0 0 0 0 0 0 0 0 0
4.1607 2.2875 -1.2471 H 0 0 0 0 0 0 0 0 0 0 0 0
0.5053 0.3954 2.2727 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.9174 0.7317 2.6481 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.3700 -0.9389 -1.6983 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.7198 -1.0026 -2.4338 H 0 0 0 0 0 0 0 0 0 0 0 0
-5.1163 -0.6531 -2.0150 H 0 0 0 0 0 0 0 0 0 0 0 0
-5.8559 0.1875 0.1813 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.1384 0.6623 1.9268 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