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
   -1.3026   -0.3934    0.3887 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0052    0.1749   -0.0581 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0095    1.2814   -0.7712 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2960   -0.4890    0.2913 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3633   -2.1468   -0.3573 Cl  0  0  0  0  0  0  0  0  0  0  0  0
   -2.0074   -0.4450   -0.4715 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7289    0.3591    1.1020 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2253   -1.3951    0.8049 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.9308    1.6994   -1.0985 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9499    1.7450   -1.0128 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.1213    0.0675   -0.1972 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.5070   -0.4581    1.3798 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