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
    1.1624   -0.7567    0.2854 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0668    0.1490   -0.1528 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2673    1.2424   -0.8666 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3294   -0.1822    0.2253 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5032   -0.2377    1.9924 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    2.0468   -0.7107   -0.3956 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.4464   -0.4373    1.3115 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.7399   -1.7872    0.2932 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.2876    1.5095   -1.1587 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5744    1.8507   -1.1480 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0552    0.5503   -0.1613 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5550   -1.1901   -0.2250 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