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
   -1.3160   -0.3588    0.0970 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0308    0.1982   -0.0946 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2294    1.4617   -0.3692 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1926   -0.6981    0.0272 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1446   -1.3615    1.6954 Cl  0  0  0  0  0  0  0  0  0  0  0  0
   -1.6082   -0.9976   -0.7776 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1113    0.4094    0.1835 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4011   -0.9682    1.0454 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.2205    1.8824   -0.5124 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5883    2.1956   -0.4764 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.1543   -0.1805   -0.1669 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.0526   -1.5824   -0.6513 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