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
    1.2889   -0.5036   -0.1586 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1493   -0.1678   -0.0121 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0571   -1.0762    0.2552 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5535    1.2522   -0.1779 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2806    2.2830    1.0410 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    1.5304   -1.2473    0.6431 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.5227   -0.8852   -1.1721 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.9034    0.3902    0.0676 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0958   -0.8201    0.3589 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7934   -2.1107    0.3803 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2473    1.5472   -1.2021 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6296    1.3383   -0.0233 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