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
   -1.7848    0.2585    0.5725 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8913   -0.0538   -0.4779 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4372    0.4512   -0.0458 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4500   -0.3624    0.0850 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5460    2.1795    0.2691 Cl  0  0  0  0  0  0  0  0  0  0  0  0
   -1.4719   -0.3255    1.3351 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2226    0.4215   -1.4212 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8156   -1.1529   -0.5962 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.4187   -0.0015    0.3989 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.3343   -1.4146   -0.1196 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