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
-1.1121 -0.1139 -0.0747 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2250 0.1355 0.4664 C 0 0 0 0 0 0 0 0 0 0 0 0
1.2648 0.0440 -0.3431 C 0 0 0 0 0 0 0 0 0 0 0 0
0.5391 0.5545 2.1471 Cl 0 0 0 0 0 0 0 0 0 0 0 0
-1.8726 -0.3919 0.6845 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.0761 -0.9917 -0.7833 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.4134 0.7568 -0.6938 H 0 0 0 0 0 0 0 0 0 0 0 0
1.1469 -0.2112 -1.3963 H 0 0 0 0 0 0 0 0 0 0 0 0
2.2983 0.2178 -0.0067 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