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
2.8055 0.3421 0.0144 C 0 0 0 0 0 0 0 0 0 0 0 0
1.8474 -0.5547 0.0523 C 0 0 0 0 0 0 0 0 0 0 0 0
0.4223 -0.2574 0.0191 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.5190 -1.2788 0.0638 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.8764 -1.0408 0.0347 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.3782 0.2398 -0.0413 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.4601 1.2644 -0.0865 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0907 1.0197 -0.0569 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5952 1.4065 -0.0464 H 0 0 0 0 0 0 0 0 0 0 0 0
3.8464 0.0459 0.0430 H 0 0 0 0 0 0 0 0 0 0 0 0
2.1492 -1.5893 0.1126 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.1375 -2.2971 0.1241 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.5877 -1.8758 0.0720 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.4400 0.4449 -0.0651 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.8048 2.2933 -0.1469 H 0 0 0 0 0 0 0 0 0 0 0 0
0.6283 1.8374 -0.0931 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