Monomers

3-Chloro-2-methylpropene

Identifiers

IUPAC name
3-chloro-2-methylprop-1-ene
InchI
InChI=1S/C4H7Cl/c1-4(2)3-5/h1,3H2,2H3
InchI Key
OHXAOPZTJOUYKM-UHFFFAOYSA-N
SMILES
CC(=C)CCl
Canonical SMILES
CC(=C)CCl
Isomeric SMILES
CC(=C)CCl
Resources
cid=

Structures

2D Structure
3D Structure

Molecular Formula and Computed Descriptors

Molecular Formula
C4H7Cl
Heavy Atom Count
5
Molecular Weight
90.553
Exact Molecular Weight
90.0236
Valence Electrons
30
Radical Electrons
0
tPSA
0.0
MolLogP
1.8013
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

 12 11  0  0  0  0  0  0  0  0999 V2000
   -1.1094   -0.5422    0.6488 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0396    0.2197   -0.0426 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0079    1.5277   -0.1281 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0474   -0.5651   -0.6663 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8095   -1.4917    0.6730 Cl  0  0  0  0  0  0  0  0  0  0  0  0
   -2.0631   -0.0044    0.4827 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2131   -1.5484    0.2070 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8842   -0.6141    1.7321 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7580    2.1951    0.2959 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.8085    2.0012   -0.6503 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6225   -1.2678   -1.4305 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.7874    0.0901   -1.1217 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
  4  5  1  0
  1  6  1  0
  1  7  1  0
  1  8  1  0
  3  9  1  0
  3 10  1  0
  4 11  1  0
  4 12  1  0
M  END

Similar Monomers

Structure
Similarity
IUPAC name
MF
Copolymers