Monomers

2-Chloro-2-propen-1-ol

Identifiers

IUPAC name
2-chloroprop-2-en-1-ol
InchI
InChI=1S/C3H5ClO/c1-3(4)2-5/h5H,1-2H2
InchI Key
OSCXYTRISGREIM-UHFFFAOYSA-N
SMILES
OCC(=C)Cl
Canonical SMILES
C=C(CO)Cl
Isomeric SMILES
C=C(CO)Cl
Resources
cid=

Structures

2D Structure
3D Structure

Molecular Formula and Computed Descriptors

Molecular Formula
C3H5ClO
Heavy Atom Count
5
Molecular Weight
92.525
Exact Molecular Weight
92.0029
Valence Electrons
30
Radical Electrons
0
tPSA
20.23
MolLogP
0.7312
H Bond Acceptors
1
H Bond Donors
1
Aliphatic Carbocycles
0
Aromatic Carbocycles
0
Aliphatic Heterocycles
0
Aromatic Heterocycles
0
Aliphatic Rings
0
Aromatic Rings
0

MOL File


     RDKit          3D

 10  9  0  0  0  0  0  0  0  0999 V2000
   -1.7293   -0.6863    0.3417 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8749    0.0331   -0.5239 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2866    0.4375    0.3082 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4796   -0.0019   -0.0732 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0428    1.4442    1.7123 Cl  0  0  0  0  0  0  0  0  0  0  0  0
   -1.1248   -1.2612    0.8811 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4635    0.9365   -0.8235 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5913   -0.5554   -1.3969 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6281   -0.6263   -0.9447 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.3468    0.2799    0.5189 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  1  0
  3  4  2  3
  3  5  1  0
  1  6  1  0
  2  7  1  0
  2  8  1  0
  4  9  1  0
  4 10  1  0
M  END

Similar Monomers

Structure
Similarity
IUPAC name
MF
Copolymers