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
2.7810 -0.3560 0.4035 C 0 0 0 0 0 0 0 0 0 0 0 0
1.8747 0.4899 0.0161 C 0 0 0 0 0 0 0 0 0 0 0 0
0.4331 0.2402 0.0881 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.1048 -0.9297 0.5794 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.4740 -1.1645 0.6467 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.3637 -0.2053 0.2110 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.8417 0.9721 -0.2838 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.4815 1.1919 -0.3449 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5536 -1.3303 0.8182 H 0 0 0 0 0 0 0 0 0 0 0 0
3.8358 -0.0550 0.2998 H 0 0 0 0 0 0 0 0 0 0 0 0
2.1721 1.4619 -0.3959 H 0 0 0 0 0 0 0 0 0 0 0 0
0.5769 -1.6971 0.9271 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.8873 -2.0870 1.0343 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.4361 -0.3763 0.2582 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.5606 1.7143 -0.6217 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.0775 2.1308 -0.7399 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