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
-4.8552 0.8921 0.3734 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.8579 -0.2033 0.2986 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.2957 -1.4370 0.1423 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.4381 0.0899 0.3964 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.0553 1.2845 0.5459 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.4538 -0.8723 0.3356 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.0990 -0.5809 0.4302 C 0 0 0 0 0 0 0 0 0 0 0 0
0.4927 -0.5751 1.6822 C 0 0 0 0 0 0 0 0 0 0 0 0
1.8239 -0.2999 1.8860 C 0 0 0 0 0 0 0 0 0 0 0 0
2.6207 -0.0111 0.7706 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0510 -0.0127 -0.4743 C 0 0 0 0 0 0 0 0 0 0 0 0
0.6973 -0.2959 -0.6481 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8354 0.2712 -1.5678 C 0 0 0 0 0 0 0 0 0 0 0 0
4.1892 0.5562 -1.4116 C 0 0 0 0 0 0 0 0 0 0 0 0
4.7351 0.5517 -0.1584 C 0 0 0 0 0 0 0 0 0 0 0 0
3.9579 0.2704 0.9250 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.9039 1.3269 1.4064 H 0 0 0 0 0 0 0 0 0 0 0 0
-5.8534 0.5468 0.0328 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.5093 1.7081 -0.2951 H 0 0 0 0 0 0 0 0 0 0 0 0
-5.3457 -1.6825 0.0668 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.5614 -2.2267 0.0890 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.1035 -0.7960 2.5646 H 0 0 0 0 0 0 0 0 0 0 0 0
2.2806 -0.2969 2.8670 H 0 0 0 0 0 0 0 0 0 0 0 0
0.2745 -0.2906 -1.6370 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3816 0.2704 -2.5639 H 0 0 0 0 0 0 0 0 0 0 0 0
4.8073 0.7803 -2.2769 H 0 0 0 0 0 0 0 0 0 0 0 0
5.7925 0.7670 0.0364 H 0 0 0 0 0 0 0 0 0 0 0 0
4.3927 0.2653 1.9387 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