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
   -0.8573   -1.0794   -0.1756 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0739    0.1723    0.0243 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7466    1.3042   -0.0824 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3810    0.1128    0.3255 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2953   -0.6982   -0.9712 Cl  0  0  0  0  0  0  0  0  0  0  0  0
   -0.2626   -1.9872    0.0493 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6934   -1.0314    0.5813 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2813   -1.0739   -1.1988 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2372    2.2529    0.0516 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8036    1.3544   -0.3011 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.5013   -0.4623    1.2650 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.7782    1.1359    0.4321 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