Monomers
Styrene
Identifiers
IUPAC name
styrene
InchI
InChI=1S/C8H8/c1-2-8-6-4-3-5-7-8/h2-7H,1H2
InchI Key
PPBRXRYQALVLMV-UHFFFAOYSA-N
SMILES
C=Cc1ccccc1
Canonical SMILES
C=CC1=CC=CC=C1
Isomeric SMILES
C=CC1=CC=CC=C1
Resources
Structures
2D Structure
3D Structure
Molecular Formula and Computed Descriptors
Molecular Formula
C8H8
Heavy Atom Count
8
Molecular Weight
104.152
Exact Molecular Weight
104.0626
Valence Electrons
40
Radical Electrons
0
tPSA
0.0
MolLogP
2.3296
H Bond Acceptors
0
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
16 16 0 0 0 0 0 0 0 0999 V2000
2.7185 -0.0867 -0.4700 C 0 0 0 0 0 0 0 0 0 0 0 0
1.6909 -0.8523 -0.1951 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3499 -0.3184 -0.0500 C 0 0 0 0 0 0 0 0 0 0 0 0
0.1064 1.0297 -0.1980 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.2038 1.5012 -0.0493 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.2186 0.6040 0.2418 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.9807 -0.7439 0.3907 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.6992 -1.2046 0.2451 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7205 -0.5301 -0.5722 H 0 0 0 0 0 0 0 0 0 0 0 0
2.6773 0.9801 -0.6119 H 0 0 0 0 0 0 0 0 0 0 0 0
1.8609 -1.9212 -0.0740 H 0 0 0 0 0 0 0 0 0 0 0 0
0.8680 1.7618 -0.4246 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.4319 2.5557 -0.1589 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.2397 0.9374 0.3625 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.7717 -1.4423 0.6174 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.4471 -2.2704 0.3524 H 0 0 0 0 0 0 0 0 0 0 0 0
1 2 2 3
2 3 1 0
3 4 2 0
4 5 1 0
5 6 2 0
6 7 1 0
7 8 2 0
8 3 1 0
1 9 1 0
1 10 1 0
2 11 1 0
4 12 1 0
5 13 1 0
6 14 1 0
7 15 1 0
8 16 1 0
M END
Similar Monomers
Structure
Similarity
IUPAC name
MF
Copolymers