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
1.1101 -0.1051 -0.1116 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2675 0.4587 -0.0849 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.2436 -0.3485 0.2857 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.6563 2.0997 -0.5092 Cl 0 0 0 0 0 0 0 0 0 0 0 0
1.8805 0.6737 -0.2642 H 0 0 0 0 0 0 0 0 0 0 0 0
1.1385 -0.7732 -1.0016 H 0 0 0 0 0 0 0 0 0 0 0 0
1.3286 -0.6766 0.8189 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.0379 -1.3806 0.5580 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.2524 0.0519 0.3089 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