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
   -1.1782   -0.5611   -0.4549 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0054    0.2309    0.0114 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1368    1.5248    0.2876 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2831   -0.4930    0.1450 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0118   -1.8022    1.3399 Cl  0  0  0  0  0  0  0  0  0  0  0  0
   -2.1237   -0.0674   -0.1505 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0810   -0.5755   -1.5810 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1280   -1.5652   -0.0259 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0421    2.0752    0.2037 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.7558    2.0480    0.6236 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.1188    0.1549    0.4267 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.5257   -0.9694   -0.8257 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