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
4.0118 0.6009 -0.1717 C 0 0 0 0 0 0 0 0 0 0 0 0
2.9785 -0.1489 -0.4860 C 0 0 0 0 0 0 0 0 0 0 0 0
2.1636 -0.6029 0.5310 O 0 0 0 0 0 0 0 0 0 0 0 0
0.7957 -0.4175 0.4101 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2541 0.2052 -0.6975 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.1019 0.4045 -0.8474 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.9800 -0.0232 0.1298 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.4491 -0.6445 1.2365 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0946 -0.8438 1.3867 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.4389 0.1959 -0.0404 C 0 0 0 0 0 0 0 0 0 0 0 0
4.1967 0.8422 0.8717 H 0 0 0 0 0 0 0 0 0 0 0 0
4.6835 0.9807 -0.9583 H 0 0 0 0 0 0 0 0 0 0 0 0
2.8021 -0.3823 -1.5109 H 0 0 0 0 0 0 0 0 0 0 0 0
0.9664 0.5389 -1.4646 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.4985 0.9034 -1.7412 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.1724 -0.9703 1.9904 H 0 0 0 0 0 0 0 0 0 0 0 0
0.2796 -1.3367 2.2730 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.7068 1.1262 0.4818 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.7077 0.2616 -1.1248 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.9822 -0.6894 0.3913 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