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
    1.5944    0.2377   -0.9474 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.8008   -0.1613    0.1227 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5347    0.4678    0.1105 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5895   -0.2950    0.0447 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7407    2.2021    0.1818 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    2.5372    0.0107   -0.6810 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6788   -1.2545    0.0318 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.3191   -0.0004    1.1018 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5023   -1.3674   -0.0006 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5631    0.1601    0.0357 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