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
2.7829 0.1527 0.1971 C 0 0 0 0 0 0 0 0 0 0 0 0
1.7631 -0.6207 0.4837 C 0 0 0 0 0 0 0 0 0 0 0 0
0.4107 -0.2486 0.1647 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.6388 -1.1165 0.4957 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.9539 -0.8263 0.2213 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.3175 0.3409 -0.3982 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.2991 1.1999 -0.7278 C 0 0 0 0 0 0 0 0 0 0 0 0
0.0441 0.9252 -0.4584 C 0 0 0 0 0 0 0 0 0 0 0 0
2.6257 1.0900 -0.2872 H 0 0 0 0 0 0 0 0 0 0 0 0
3.8052 -0.1117 0.4297 H 0 0 0 0 0 0 0 0 0 0 0 0
1.9392 -1.5807 0.9812 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.3548 -2.0524 0.9918 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.7306 -1.5324 0.4982 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.3426 0.5916 -0.6243 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.5388 2.1450 -1.2241 H 0 0 0 0 0 0 0 0 0 0 0 0
0.8052 1.6442 -0.7433 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