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
   -1.1490   -0.7636   -0.4778 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0579    0.1177    0.0406 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3673    1.2694    0.5968 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3522   -0.3426   -0.0916 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3885    0.9140    0.6113 Cl  0  0  0  0  0  0  0  0  0  0  0  0
   -1.5450   -0.3170   -1.3897 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9394   -0.7651    0.2909 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7901   -1.7977   -0.5901 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.3796    1.9595    0.9952 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3948    1.5691    0.6752 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6171   -0.5637   -1.1427 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.5061   -1.2800    0.4820 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