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
   -1.2679   -0.3968   -0.4799 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0126    0.1698    0.0786 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0794    1.4699    0.2908 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1499   -0.6766    0.4093 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6823   -1.5008   -1.0925 Cl  0  0  0  0  0  0  0  0  0  0  0  0
   -1.9460   -0.7914    0.3272 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9792   -1.2275   -1.1716 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8700    0.3609   -1.0175 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7570    2.1212    0.0587 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.9964    1.9102    0.7024 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.9325   -1.4196    1.2038 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.9923   -0.0194    0.6908 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