Monomers
2-Chloropropene
Identifiers
IUPAC name
2-chloroprop-1-ene
InchI
InChI=1S/C3H5Cl/c1-3(2)4/h1H2,2H3
InchI Key
PNLQPWWBHXMFCA-UHFFFAOYSA-N
SMILES
CC(=C)Cl
Canonical SMILES
CC(=C)Cl
Isomeric SMILES
CC(=C)Cl
Structures
2D Structure
3D Structure
Molecular Formula and Computed Descriptors
Molecular Formula
C3H5Cl
Heavy Atom Count
4
Molecular Weight
76.526
Exact Molecular Weight
76.008
Valence Electrons
24
Radical Electrons
0
tPSA
0.0
MolLogP
1.7588
H Bond Acceptors
0
H Bond Donors
0
Aliphatic Carbocycles
0
Aromatic Carbocycles
0
Aliphatic Heterocycles
0
Aromatic Heterocycles
0
Aliphatic Rings
0
Aromatic Rings
0
MOL File
RDKit 3D
9 8 0 0 0 0 0 0 0 0999 V2000
1.0843 -0.2535 -0.0068 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.1940 0.4771 -0.1185 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.3290 -0.1451 0.1201 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2114 2.1609 -0.5647 Cl 0 0 0 0 0 0 0 0 0 0 0 0
0.9768 -1.3531 -0.1415 H 0 0 0 0 0 0 0 0 0 0 0 0
1.8396 0.0758 -0.7685 H 0 0 0 0 0 0 0 0 0 0 0 0
1.4629 -0.0979 1.0245 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.3050 0.3307 0.0566 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.3242 -1.1950 0.3987 H 0 0 0 0 0 0 0 0 0 0 0 0
1 2 1 0
2 3 2 3
2 4 1 0
1 5 1 0
1 6 1 0
1 7 1 0
3 8 1 0
3 9 1 0
M END
Similar Monomers
Structure
Similarity
IUPAC name
MF
Copolymers