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
    1.4004   -0.0900   -0.0721 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0850   -0.1628    0.0110 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6133   -1.2988    0.4391 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9385    0.9923   -0.3709 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5821    2.4260    0.6298 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    1.8317   -0.5357    0.8699 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.7215    0.9542   -0.2026 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.7321   -0.6932   -0.9339 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6894   -1.4425    0.5320 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0048   -2.1403    0.7175 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7984    1.2667   -1.4401 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9837    0.7243   -0.1795 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