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
2.6203 -0.8858 0.5246 C 0 0 0 0 0 0 0 0 0 0 0 0
1.8824 0.1768 0.4208 C 0 0 0 0 0 0 0 0 0 0 0 0
0.4521 0.1823 0.1086 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2546 1.3668 0.0181 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.5985 1.3815 -0.2747 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.3056 0.2207 -0.4918 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.6205 -0.9728 -0.4065 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2610 -0.9789 -0.1098 C 0 0 0 0 0 0 0 0 0 0 0 0
2.2088 -1.8542 0.3825 H 0 0 0 0 0 0 0 0 0 0 0 0
3.6784 -0.8104 0.7598 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3521 1.1515 0.5760 H 0 0 0 0 0 0 0 0 0 0 0 0
0.2735 2.3003 0.1839 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.1449 2.3172 -0.3435 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.3749 0.2486 -0.7239 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.1511 -1.8983 -0.5724 H 0 0 0 0 0 0 0 0 0 0 0 0
0.2435 -1.9454 -0.0518 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