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
-1.0837 -0.2324 -0.1034 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2105 0.4827 0.0320 C 0 0 0 0 0 0 0 0 0 0 0 0
1.3143 -0.2052 0.1028 C 0 0 0 0 0 0 0 0 0 0 0 0
0.1630 2.2369 0.0884 Cl 0 0 0 0 0 0 0 0 0 0 0 0
-1.4983 -0.3483 0.9180 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.9156 -1.2302 -0.5337 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.7914 0.3160 -0.7720 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3010 0.2547 0.2032 H 0 0 0 0 0 0 0 0 0 0 0 0
1.3003 -1.2742 0.0648 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