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
-1.0659 -0.3776 0.1619 C 0 0 0 0 0 0 0 0 0 0 0 0
0.1115 0.5121 -0.0167 C 0 0 0 0 0 0 0 0 0 0 0 0
1.3212 -0.0132 -0.1982 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0690 2.2519 0.0082 Cl 0 0 0 0 0 0 0 0 0 0 0 0
-2.0088 0.1690 0.0282 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.9782 -0.8581 1.1678 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.9657 -1.1907 -0.6031 H 0 0 0 0 0 0 0 0 0 0 0 0
1.4620 -1.0884 -0.2179 H 0 0 0 0 0 0 0 0 0 0 0 0
2.1929 0.5950 -0.3303 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