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
   -1.0594   -0.9209    0.0145 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0815    0.1898   -0.0198 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4855    1.3837   -0.4049 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3283   -0.0324    0.3714 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1157   -1.2629   -0.6670 Cl  0  0  0  0  0  0  0  0  0  0  0  0
   -1.1158   -1.2755    1.0670 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7167   -1.7112   -0.6766 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0673   -0.6215   -0.2914 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4971    1.5532   -0.6880 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.2150    2.2137   -0.4377 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.9363    0.8905    0.3140 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.4279   -0.4065    1.4186 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