Monomers
1-Methyl-4-(vinyloxy)benzene
Identifiers
IUPAC name
1-ethenoxy-4-methylbenzene
InchI
InChI=1S/C9H10O/c1-3-10-9-6-4-8(2)5-7-9/h3-7H,1H2,2H3
InchI Key
YXHRYLHTQVXZIK-UHFFFAOYSA-N
SMILES
C=COc1ccc(cc1)C
Canonical SMILES
CC1=CC=C(C=C1)OC=C
Isomeric SMILES
CC1=CC=C(C=C1)OC=C
Structures
2D Structure
3D Structure
Molecular Formula and Computed Descriptors
Molecular Formula
C9H10O
Heavy Atom Count
10
Molecular Weight
134.178
Exact Molecular Weight
134.0732
Valence Electrons
52
Radical Electrons
0
tPSA
9.23
MolLogP
2.5173
H Bond Acceptors
1
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
20 20 0 0 0 0 0 0 0 0999 V2000
3.8639 0.0809 -0.7977 C 0 0 0 0 0 0 0 0 0 0 0 0
3.0960 -0.0724 0.2622 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0864 -1.0463 0.2548 O 0 0 0 0 0 0 0 0 0 0 0 0
0.7546 -0.6633 0.2015 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3920 0.6686 0.1550 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.9294 1.0679 0.1016 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.9603 0.1499 0.0921 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.5952 -1.1793 0.1386 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2714 -1.5844 0.1922 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.3937 0.5724 0.0345 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7121 -0.5454 -1.6695 H 0 0 0 0 0 0 0 0 0 0 0 0
4.6307 0.8379 -0.7608 H 0 0 0 0 0 0 0 0 0 0 0 0
3.2297 0.5410 1.1420 H 0 0 0 0 0 0 0 0 0 0 0 0
1.2053 1.3958 0.1624 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.1896 2.1286 0.0655 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.4114 -1.9095 0.1312 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.0017 -2.6427 0.2286 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.5980 0.8267 -1.0180 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.5504 1.5312 0.6093 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.0693 -0.1576 0.4746 H 0 0 0 0 0 0 0 0 0 0 0 0
1 2 2 3
2 3 1 0
3 4 1 0
4 5 2 0
5 6 1 0
6 7 2 0
7 8 1 0
8 9 2 0
7 10 1 0
9 4 1 0
1 11 1 0
1 12 1 0
2 13 1 0
5 14 1 0
6 15 1 0
8 16 1 0
9 17 1 0
10 18 1 0
10 19 1 0
10 20 1 0
M END
Similar Monomers
Structure
Similarity
IUPAC name
MF
Copolymers