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
   -1.2597   -0.6034   -0.0475 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0024    0.1554    0.1208 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1157    1.0415    1.1027 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1449   -0.0601   -0.8020 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7149   -1.7454   -0.7589 Cl  0  0  0  0  0  0  0  0  0  0  0  0
   -1.2150   -1.6227    0.4149 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5404   -0.6903   -1.1279 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1260   -0.1003    0.4370 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.0132    1.6232    1.2704 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7094    1.2117    1.7843 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.8551    0.2055   -1.8490 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0092    0.5849   -0.5447 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