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
-1.0563 -0.2327 -0.3374 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2241 0.4330 0.0358 C 0 0 0 0 0 0 0 0 0 0 0 0
1.2846 -0.2173 0.4555 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2802 2.1780 -0.1059 Cl 0 0 0 0 0 0 0 0 0 0 0 0
-1.8177 -0.1570 0.4685 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.4590 0.2830 -1.2286 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.9027 -1.3236 -0.5455 H 0 0 0 0 0 0 0 0 0 0 0 0
2.1775 0.3223 0.7088 H 0 0 0 0 0 0 0 0 0 0 0 0
1.2694 -1.2857 0.5488 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