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
    1.2731    0.2790   -0.4924 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0336   -0.1865    0.0445 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0953   -1.3397    0.6803 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2718    0.6527   -0.1377 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0062    2.2283    0.6446 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    1.7384   -0.5737   -1.0102 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.1987    1.1745   -1.1062 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.9223    0.4867    0.4012 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0380   -1.6921    1.0765 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.7948   -1.9315    0.8050 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3829    0.7711   -1.2420 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0997    0.1313    0.3363 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