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
-2.6166 -0.7749 0.4606 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.8988 0.0245 -0.2986 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.4633 0.0929 -0.1666 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2578 0.9552 -0.9931 C 0 0 0 0 0 0 0 0 0 0 0 0
1.6340 1.0790 -0.9293 C 0 0 0 0 0 0 0 0 0 0 0 0
2.3131 0.3134 -0.0063 C 0 0 0 0 0 0 0 0 0 0 0 0
1.6451 -0.5518 0.8309 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2468 -0.6522 0.7387 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.1998 -1.4195 1.2154 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.7047 -0.8378 0.3723 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.4012 0.6457 -1.0406 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.3056 1.5341 -1.6982 H 0 0 0 0 0 0 0 0 0 0 0 0
2.1812 1.7422 -1.5661 H 0 0 0 0 0 0 0 0 0 0 0 0
3.3964 0.3556 0.1034 H 0 0 0 0 0 0 0 0 0 0 0 0
2.1612 -1.1603 1.5611 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.2456 -1.3459 1.4163 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