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
    1.4355    0.0053   -0.1610 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0341    0.1545   -0.0349 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6204    1.3320   -0.2024 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8230   -1.0625    0.2854 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5337   -0.5917    0.3743 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    1.8936   -0.0406    0.8664 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6374   -1.0036   -0.5991 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8913    0.7724   -0.7978 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6876    1.4545   -0.1136 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0309    2.2099   -0.4356 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4917   -1.3901    1.3011 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6364   -1.8400   -0.4828 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