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
   -1.1914   -0.6545    0.2801 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0074    0.1926    0.0480 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0640    1.3703    0.6443 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0827   -0.3195   -0.8390 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7770   -1.8428   -0.2344 Cl  0  0  0  0  0  0  0  0  0  0  0  0
   -1.2213   -1.5012   -0.4192 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0885    0.0020    0.1456 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1597   -0.9815    1.3517 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.9273    2.0114    0.4938 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7214    1.7096    1.2737 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8639    0.4813   -0.8915 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6600   -0.4676   -1.8530 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