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
   -0.6343   -1.2110    0.1829 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1227    0.1599    0.0192 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9654    1.1561   -0.0122 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3290    0.3938   -0.1071 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0321   -0.4338   -1.5095 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    0.0416   -1.9234   -0.3238 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6990   -1.4035    1.2905 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6932   -1.3222   -0.1864 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6978    2.2016   -0.1282 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0218    0.9502    0.0829 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8358   -0.0365    0.8037 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.5959    1.4688   -0.1120 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