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
    0.9671    0.1625   -0.9462 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0868   -0.2076    0.0152 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2918   -1.5006    0.3170 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8964    0.8680    0.6258 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2191    1.9546    1.5187 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    1.9153    0.2995   -0.3495 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.7735    1.1617   -1.4082 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.1232   -0.5847   -1.7473 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0529   -1.8250    1.0167 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.3048   -2.2846   -0.1338 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3092    1.4900   -0.2047 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6660    0.4662    1.2963 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