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
   -1.3278   -0.5133    0.1189 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1022   -0.1443   -0.0255 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0228   -1.0620   -0.2099 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4352    1.3069    0.0491 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1623    1.5943   -0.1377 Cl  0  0  0  0  0  0  0  0  0  0  0  0
   -1.9169   -0.3061   -0.8131 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8077    0.1074    0.9307 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4396   -1.5601    0.4533 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.7457   -2.1017   -0.2586 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0666   -0.8253   -0.3179 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0773    1.8339   -0.8080 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0344    1.6703    1.0188 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