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
    1.3548   -0.2494   -0.1722 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0483    0.1918    0.0314 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3126    1.4666    0.0454 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1196   -0.8144    0.2142 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2728   -1.9050   -1.1729 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    1.9681    0.2707    0.5901 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.4911   -1.3322   -0.0464 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6516    0.1060   -1.1869 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.4702    2.1873   -0.0879 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3076    1.8770    0.1877 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0748   -0.3453    0.5080 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8001   -1.4532    1.0894 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