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
    1.2496   -0.6428   -0.0787 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0077    0.1825    0.0207 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0915    1.4725   -0.2422 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2937   -0.3784    0.3963 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7377   -1.6433   -0.8087 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    2.0386   -0.1373   -0.6449 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6692   -0.8623    0.9360 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.0551   -1.6265   -0.5476 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7386    2.1627   -0.2021 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.0496    1.8827   -0.5182 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3277   -0.8170    1.4092 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0636    0.4072    0.2801 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