Monomers

1-(4-Vinylphenyl)-1-propanol

Identifiers

IUPAC name
1-(4-ethenylphenyl)propan-1-ol
InchI
InChI=1S/C11H14O/c1-3-9-5-7-10(8-6-9)11(12)4-2/h3,5-8,11-12H,1,4H2,2H3
InchI Key
FNYDFLXPKVRBLU-UHFFFAOYSA-N
SMILES
CCC(c1ccc(cc1)C=C)O
Canonical SMILES
CCC(C1=CC=C(C=C1)C=C)O
Isomeric SMILES
CCC(C1=CC=C(C=C1)C=C)O
Resources
cid=

Structures

2D Structure
3D Structure

Molecular Formula and Computed Descriptors

Molecular Formula
C11H14O
Heavy Atom Count
12
Molecular Weight
162.232
Exact Molecular Weight
162.1045
Valence Electrons
64
Radical Electrons
0
tPSA
20.23
MolLogP
2.773
H Bond Acceptors
1
H Bond Donors
1
Aliphatic Carbocycles
0
Aromatic Carbocycles
1
Aliphatic Heterocycles
0
Aromatic Heterocycles
0
Aliphatic Rings
0
Aromatic Rings
1

MOL File


     RDKit          3D

 26 26  0  0  0  0  0  0  0  0999 V2000
   -2.7337    0.3861   -1.7242 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7368   -0.7298   -0.7402 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0263   -0.4880    0.5368 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5895   -0.1952    0.4493 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0722   -0.0418    1.6714 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4245    0.2290    1.7160 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1885    0.3617    0.5748 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5186    0.2071   -0.6173 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1464   -0.0682   -0.6818 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6176    0.6483    0.6393 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3934    0.7845   -0.4072 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2873   -1.5153    1.4357 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1823    1.2956   -1.4142 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7921    0.7584   -1.8776 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4086    0.0986   -2.7555 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4046   -1.6454   -1.2762 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8075   -0.9566   -0.4707 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5024    0.4410    0.9938 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4911   -0.1379    2.6097 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.9456    0.3498    2.6759 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0383    0.2945   -1.5582 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3348   -0.1856   -1.6244 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.0402    0.7508    1.6510 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.4322    0.9945   -0.2729 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.9968    0.6877   -1.3896 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5174   -2.3237    0.8947 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  1  0
  3  4  1  0
  4  5  2  0
  5  6  1  0
  6  7  2  0
  7  8  1  0
  8  9  2  0
  7 10  1  0
 10 11  2  3
  3 12  1  0
  9  4  1  0
  1 13  1  0
  1 14  1  0
  1 15  1  0
  2 16  1  0
  2 17  1  0
  3 18  1  0
  5 19  1  0
  6 20  1  0
  8 21  1  0
  9 22  1  0
 10 23  1  0
 11 24  1  0
 11 25  1  0
 12 26  1  0
M  END

Similar Monomers

Structure
Similarity
IUPAC name
MF
Copolymers