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
-1.1040 -0.1591 -0.1706 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2079 0.4904 0.0408 C 0 0 0 0 0 0 0 0 0 0 0 0
1.2803 -0.2528 -0.2203 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3299 2.1432 0.6028 Cl 0 0 0 0 0 0 0 0 0 0 0 0
-1.0961 -1.1016 0.4237 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.9553 0.4288 0.1781 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.1569 -0.4630 -1.2278 H 0 0 0 0 0 0 0 0 0 0 0 0
1.2387 -1.2763 -0.5685 H 0 0 0 0 0 0 0 0 0 0 0 0
2.2556 0.1904 -0.0766 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