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
2.6694 -0.7016 0.2629 C 0 0 0 0 0 0 0 0 0 0 0 0
1.8570 0.1130 -0.3831 C 0 0 0 0 0 0 0 0 0 0 0 0
0.4178 0.1085 -0.1645 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2174 -0.7382 0.7272 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.5814 -0.7015 0.8959 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.3184 0.1929 0.1638 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.6831 1.0560 -0.7431 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3280 1.0255 -0.9164 C 0 0 0 0 0 0 0 0 0 0 0 0
2.3183 -1.4180 0.9897 H 0 0 0 0 0 0 0 0 0 0 0 0
3.7525 -0.6359 0.0396 H 0 0 0 0 0 0 0 0 0 0 0 0
2.2982 0.8137 -1.1086 H 0 0 0 0 0 0 0 0 0 0 0 0
0.3786 -1.4499 1.3082 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.0444 -1.3625 1.5870 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.3937 0.2353 0.2842 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.2768 1.7678 -1.3246 H 0 0 0 0 0 0 0 0 0 0 0 0
0.1514 1.6950 -1.6180 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