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
    1.2557   -0.6474    0.0468 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0092    0.1403   -0.0997 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1115    1.3875   -0.5124 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3373   -0.4049    0.1939 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3990   -0.9089    1.8982 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    1.6514   -0.8368   -0.9860 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.9656   -0.0028    0.6324 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.1167   -1.5733    0.6188 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.1061    1.7742   -0.7241 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7805    2.0036   -0.6341 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5705   -1.2770   -0.4502 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1288    0.3454    0.0163 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