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
-1.0356 -0.1891 -0.2316 C 0 0 0 0 0 0 0 0 0 0 0 0
0.0923 0.3099 0.5562 C 0 0 0 0 0 0 0 0 0 0 0 0
1.3380 0.1782 0.1370 C 0 0 0 0 0 0 0 0 0 0 0 0
1.6238 -0.6124 -1.3947 Cl 0 0 0 0 0 0 0 0 0 0 0 0
-0.7684 -0.4999 -1.2587 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.5125 -1.0966 0.2368 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.8352 0.5805 -0.2352 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.0934 0.7934 1.4944 H 0 0 0 0 0 0 0 0 0 0 0 0
2.1910 0.5360 0.6958 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