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
-2.7078 -0.6761 0.3544 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.9056 0.1664 -0.2566 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.4585 0.1402 -0.1407 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2163 -0.7798 0.6288 C 0 0 0 0 0 0 0 0 0 0 0 0
1.6017 -0.7607 0.7050 C 0 0 0 0 0 0 0 0 0 0 0 0
2.3763 0.1568 0.0329 C 0 0 0 0 0 0 0 0 0 0 0 0
1.6983 1.0769 -0.7368 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3286 1.0720 -0.8232 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.3428 -1.4588 0.9952 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.7864 -0.6313 0.2481 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.3428 0.9310 -0.8879 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.3476 -1.5413 1.1918 H 0 0 0 0 0 0 0 0 0 0 0 0
2.1172 -1.4907 1.3143 H 0 0 0 0 0 0 0 0 0 0 0 0
3.4551 0.1824 0.0838 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3009 1.8053 -1.2712 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.2027 1.8077 -1.4379 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