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
2.7248 0.5939 -0.1926 C 0 0 0 0 0 0 0 0 0 0 0 0
1.8815 -0.4164 -0.1910 C 0 0 0 0 0 0 0 0 0 0 0 0
0.4497 -0.2215 -0.0542 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.4124 -1.3294 -0.0577 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7674 -1.1927 0.0684 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.3701 0.0378 0.2064 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.5388 1.1318 0.2115 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.1677 1.0046 0.0847 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7947 0.4374 -0.2955 H 0 0 0 0 0 0 0 0 0 0 0 0
2.4269 1.6278 -0.0944 H 0 0 0 0 0 0 0 0 0 0 0 0
2.2645 -1.4077 -0.2935 H 0 0 0 0 0 0 0 0 0 0 0 0
0.0738 -2.3078 -0.1680 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.3909 -2.0780 0.0601 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.4432 0.1189 0.3044 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.9855 2.1040 0.3180 H 0 0 0 0 0 0 0 0 0 0 0 0
0.4600 1.8971 0.0932 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