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
    1.6848    0.7163    0.3022 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.7547   -0.0797   -0.3496 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6386    0.2592    0.0096 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4056   -0.6567    0.5647 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3184    1.8536   -0.2783 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    2.3884    1.0671   -0.2713 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.9453    0.0313   -1.4439 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.0031   -1.1313   -0.1073 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4362   -0.4245    0.8364 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9775   -1.6351    0.7376 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