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
-2.3257 2.4800 0.7328 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.8427 1.3236 0.3730 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.2421 0.1335 0.7654 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.9815 -0.2189 0.2969 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2777 0.5820 -0.5654 C 0 0 0 0 0 0 0 0 0 0 0 0
0.9738 0.2625 -1.0487 C 0 0 0 0 0 0 0 0 0 0 0 0
1.5352 -0.9369 -0.6297 C 0 0 0 0 0 0 0 0 0 0 0 0
0.8403 -1.7541 0.2377 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.4264 -1.4099 0.7144 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8959 -1.2998 -1.1458 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.4305 2.4766 1.3356 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.7625 3.4019 0.4481 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.7394 1.3521 -0.2305 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.7289 1.5213 -0.8872 H 0 0 0 0 0 0 0 0 0 0 0 0
1.5073 0.9200 -1.7328 H 0 0 0 0 0 0 0 0 0 0 0 0
1.2845 -2.6859 0.5589 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.9426 -2.0707 1.3910 H 0 0 0 0 0 0 0 0 0 0 0 0
2.8608 -1.4031 -2.2609 H 0 0 0 0 0 0 0 0 0 0 0 0
3.2182 -2.2125 -0.6433 H 0 0 0 0 0 0 0 0 0 0 0 0
3.5842 -0.4617 -0.8704 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