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
-1.1316 -0.1017 0.0320 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2612 0.4542 -0.0162 C 0 0 0 0 0 0 0 0 0 0 0 0
1.3135 -0.3562 -0.0138 C 0 0 0 0 0 0 0 0 0 0 0 0
0.5500 2.1816 -0.0770 Cl 0 0 0 0 0 0 0 0 0 0 0 0
-1.5822 0.0029 1.0430 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.0968 -1.1849 -0.2066 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.7658 0.3936 -0.7372 H 0 0 0 0 0 0 0 0 0 0 0 0
1.1213 -1.4187 0.0240 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3305 0.0293 -0.0483 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