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
    1.5444    0.9780    0.5163 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.7376    0.3290   -0.4195 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3541   -0.4544    0.2348 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6363   -0.2091    0.0008 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0098   -1.7577    1.3622 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    2.4217    0.5562    0.5829 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.2425    1.1244   -1.0117 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.3052   -0.3921   -1.0401 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8580    0.5934   -0.6933 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4128   -0.7678    0.4675 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