Monomers
2,5-Dichlorostyrene
Identifiers
IUPAC name
1,4-dichloro-2-ethenylbenzene
InchI
InChI=1S/C8H6Cl2/c1-2-6-5-7(9)3-4-8(6)10/h2-5H,1H2
InchI Key
IZMZREOTRMMCCB-UHFFFAOYSA-N
SMILES
C=Cc1cc(Cl)ccc1Cl
Canonical SMILES
C=CC1=C(C=CC(=C1)Cl)Cl
Isomeric SMILES
C=CC1=C(C=CC(=C1)Cl)Cl
Resources
Structures
2D Structure
3D Structure
Molecular Formula and Computed Descriptors
Molecular Formula
C8H6Cl2
Heavy Atom Count
10
Molecular Weight
173.042
Exact Molecular Weight
171.9847
Valence Electrons
52
Radical Electrons
0
tPSA
0.0
MolLogP
3.6364
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
2.6642 -0.7420 -0.2135 C 0 0 0 0 0 0 0 0 0 0 0 0
1.7852 0.1677 -0.5923 C 0 0 0 0 0 0 0 0 0 0 0 0
0.4021 0.1487 -0.2083 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.1374 -0.8358 0.6016 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.4747 -0.8392 0.9627 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.1257 -2.1055 1.9928 Cl 0 0 0 0 0 0 0 0 0 0 0 0
-2.2614 0.1851 0.4816 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7399 1.1739 -0.3264 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.4156 1.1797 -0.6855 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2201 2.4458 -1.7115 Cl 0 0 0 0 0 0 0 0 0 0 0 0
3.7101 -0.7051 -0.5191 H 0 0 0 0 0 0 0 0 0 0 0 0
2.4067 -1.5664 0.4125 H 0 0 0 0 0 0 0 0 0 0 0 0
2.1581 0.9583 -1.2265 H 0 0 0 0 0 0 0 0 0 0 0 0
0.4897 -1.6570 0.9881 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.3082 0.2010 0.7518 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.3732 1.9907 -0.7082 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 1 0
5 7 2 0
7 8 1 0
8 9 2 0
9 10 1 0
9 3 1 0
1 11 1 0
1 12 1 0
2 13 1 0
4 14 1 0
7 15 1 0
8 16 1 0
M END
Similar Monomers
Structure
Similarity
IUPAC name
MF
Copolymers