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
    1.8955    0.0613   -0.3841 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.8298    0.3237    0.4818 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4715    0.3139   -0.2506 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4027   -0.5409    0.0965 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7723    1.4250   -1.5643 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    1.6213   -0.6335   -1.0572 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.0339    1.3078    0.9433 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.8365   -0.4710    1.2541 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2307   -1.2272    0.9000 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3397   -0.5591   -0.4195 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