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
   -1.1330   -0.6504   -0.6682 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0482    0.0794    0.0496 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3486    1.2450    0.5831 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3189   -0.4341    0.1870 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3025    0.7224    1.1027 Cl  0  0  0  0  0  0  0  0  0  0  0  0
   -2.1363   -0.3040   -0.3415 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0899   -1.7390   -0.4992 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0655   -0.4064   -1.7510 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3599    1.6160    0.4768 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.4284    1.7895    1.1089 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.3687   -1.4577    0.6013 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.7630   -0.4605   -0.8494 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