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
   -1.1614   -0.5952    0.6757 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0787   -0.1569   -0.0510 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9287   -1.0018   -0.5700 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2937    1.3103   -0.1517 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7838    1.6052   -1.0292 Cl  0  0  0  0  0  0  0  0  0  0  0  0
   -1.3146   -1.6783    0.6316 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0386   -0.2068    1.7115 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9985   -0.0645    0.1904 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.8203   -2.0783   -0.5253 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8080   -0.6331   -1.0842 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5458    1.8081   -0.7058 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.3457    1.6914    0.9081 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