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
    1.3190    0.4538    0.2627 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1070    0.1529   -0.0286 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0305    1.0968    0.0512 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5562   -1.2178   -0.4210 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1481   -2.3530    0.8983 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    1.3951    0.6737    1.3394 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6181    1.3248   -0.3470 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.9368   -0.4272   -0.0161 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7090    2.0869    0.3341 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0722    0.9049   -0.1550 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6446   -1.2279   -0.5604 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0015   -1.4678   -1.3577 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