Monomers
Phenyl methacrylate
Identifiers
IUPAC name
phenyl 2-methylprop-2-enoate
InchI
InChI=1S/C10H10O2/c1-8(2)10(11)12-9-6-4-3-5-7-9/h3-7H,1H2,2H3
InchI Key
QIWKUEJZZCOPFV-UHFFFAOYSA-N
SMILES
O=C(C(=C)C)Oc1ccccc1
Canonical SMILES
CC(=C)C(=O)OC1=CC=CC=C1
Isomeric SMILES
CC(=C)C(=O)OC1=CC=CC=C1
Structures
2D Structure
3D Structure
Molecular Formula and Computed Descriptors
Molecular Formula
C10H10O2
Heavy Atom Count
12
Molecular Weight
162.188
Exact Molecular Weight
162.0681
Valence Electrons
62
Radical Electrons
0
tPSA
26.3
MolLogP
2.1681
H Bond Acceptors
2
H Bond Donors
0
Aliphatic Carbocycles
0
Aromatic Carbocycles
1
Aliphatic Heterocycles
0
Aromatic Heterocycles
0
Aliphatic Rings
0
Aromatic Rings
1
MOL File
RDKit 3D
22 22 0 0 0 0 0 0 0 0999 V2000
1.0514 0.4669 -1.2176 O 0 0 0 0 0 0 0 0 0 0 0 0
1.2066 -0.1439 -0.1144 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5269 -0.5765 0.3207 C 0 0 0 0 0 0 0 0 0 0 0 0
2.6335 -1.2040 1.4693 C 0 0 0 0 0 0 0 0 0 0 0 0
3.6824 -0.2827 -0.5618 C 0 0 0 0 0 0 0 0 0 0 0 0
0.0539 -0.3582 0.6180 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.1613 0.0874 0.1283 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.6784 1.3343 0.3915 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.9058 1.6889 -0.1456 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.6080 0.8183 -0.9318 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.0931 -0.4328 -1.1982 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.8722 -0.7851 -0.6636 C 0 0 0 0 0 0 0 0 0 0 0 0
1.7435 -1.3762 2.0473 H 0 0 0 0 0 0 0 0 0 0 0 0
3.6175 -1.5218 1.7847 H 0 0 0 0 0 0 0 0 0 0 0 0
4.3606 -1.1546 -0.5899 H 0 0 0 0 0 0 0 0 0 0 0 0
4.1841 0.6221 -0.1383 H 0 0 0 0 0 0 0 0 0 0 0 0
3.3429 -0.1037 -1.6015 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.1315 2.0134 1.0043 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.2844 2.6743 0.0795 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.5728 1.1317 -1.3385 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.6364 -1.1386 -1.8208 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.4593 -1.7593 -0.8642 H 0 0 0 0 0 0 0 0 0 0 0 0
1 2 2 0
2 3 1 0
3 4 2 3
3 5 1 0
2 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 7 1 0
4 13 1 0
4 14 1 0
5 15 1 0
5 16 1 0
5 17 1 0
8 18 1 0
9 19 1 0
10 20 1 0
11 21 1 0
12 22 1 0
M END
Similar Monomers
Structure
Similarity
IUPAC name
MF
Copolymers