Monomers
1,1-Dichloro-2-vinylcyclopropane
Identifiers
IUPAC name
1,1-dichloro-2-ethenylcyclopropane
InchI
InChI=1S/C5H6Cl2/c1-2-4-3-5(4,6)7/h2,4H,1,3H2
InchI Key
GAAAGAHNGGKSQH-UHFFFAOYSA-N
SMILES
C=CC1CC1(Cl)Cl
Canonical SMILES
C=CC1CC1(Cl)Cl
Isomeric SMILES
C=CC1CC1(Cl)Cl
Structures
2D Structure
3D Structure
Molecular Formula and Computed Descriptors
Molecular Formula
C5H6Cl2
Heavy Atom Count
7
Molecular Weight
137.009
Exact Molecular Weight
135.9847
Valence Electrons
40
Radical Electrons
0
tPSA
0.0
MolLogP
2.3662
H Bond Acceptors
0
H Bond Donors
0
Aliphatic Carbocycles
1
Aromatic Carbocycles
0
Aliphatic Heterocycles
0
Aromatic Heterocycles
0
Aliphatic Rings
1
Aromatic Rings
0
MOL File
RDKit 3D
13 13 0 0 0 0 0 0 0 0999 V2000
-2.0523 0.0679 0.0983 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.9840 -0.6929 0.2374 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3371 -0.1280 0.6223 C 0 0 0 0 0 0 0 0 0 0 0 0
0.9009 1.0107 -0.2116 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4431 -0.3497 -0.3811 C 0 0 0 0 0 0 0 0 0 0 0 0
1.0638 -1.2845 -1.8560 Cl 0 0 0 0 0 0 0 0 0 0 0 0
3.0265 -0.7557 0.3219 Cl 0 0 0 0 0 0 0 0 0 0 0 0
-1.9693 1.1259 0.2670 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.0010 -0.3417 -0.1786 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.0703 -1.7809 0.0636 H 0 0 0 0 0 0 0 0 0 0 0 0
0.5508 -0.0524 1.6901 H 0 0 0 0 0 0 0 0 0 0 0 0
1.5531 1.7400 0.2875 H 0 0 0 0 0 0 0 0 0 0 0 0
0.2016 1.4414 -0.9608 H 0 0 0 0 0 0 0 0 0 0 0 0
1 2 2 3
2 3 1 0
3 4 1 0
4 5 1 0
5 6 1 0
5 7 1 0
5 3 1 0
1 8 1 0
1 9 1 0
2 10 1 0
3 11 1 0
4 12 1 0
4 13 1 0
M END
Similar Monomers
Structure
Similarity
IUPAC name
MF
Copolymers