Monomers
1-Chloro-1-propene
Identifiers
IUPAC name
(E)-1-chloroprop-1-ene
InchI
InChI=1S/C3H5Cl/c1-2-3-4/h2-3H,1H3/b3-2+
InchI Key
OWXJKYNZGFSVRC-NSCUHMNNSA-N
SMILES
C/C=C/Cl
Canonical SMILES
CC=CCl
Isomeric SMILES
C/C=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
-0.8840 -0.2454 -0.7183 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2370 0.4761 -0.0618 C 0 0 0 0 0 0 0 0 0 0 0 0
0.8752 -0.0849 0.9305 C 0 0 0 0 0 0 0 0 0 0 0 0
2.1842 0.7722 1.6876 Cl 0 0 0 0 0 0 0 0 0 0 0 0
-0.6241 -0.4636 -1.7776 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.7960 0.3812 -0.6526 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.0728 -1.2405 -0.2362 H 0 0 0 0 0 0 0 0 0 0 0 0
0.4709 1.4574 -0.4537 H 0 0 0 0 0 0 0 0 0 0 0 0
0.6097 -1.0524 1.2822 H 0 0 0 0 0 0 0 0 0 0 0 0
1 2 1 0
2 3 2 3
3 4 1 0
1 5 1 0
1 6 1 0
1 7 1 0
2 8 1 0
3 9 1 0
M END
Similar Monomers
Structure
Similarity
IUPAC name
MF
Copolymers