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
    1.3819   -0.5149   -0.0990 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0296    0.1031    0.0374 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0840    1.3918    0.3102 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2072   -0.6848   -0.1237 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6047    0.3841    0.1083 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    1.7706   -0.8779    0.8805 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.3546   -1.3332   -0.8452 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0792    0.2740   -0.4414 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0622    1.8569    0.4128 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.8295    1.9678    0.4279 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2380   -0.9977   -1.2068 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2493   -1.5692    0.5391 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