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
   -4.0248   -0.6610   -0.4288 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5207   -0.7091   -0.5705 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8637    0.4899    0.0964 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3983    0.3511   -0.0966 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2082    0.6198   -1.3023 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5609    0.5006   -1.5114 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3459    0.0853   -0.4380 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7693   -0.1907    0.7790 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3977   -0.0572    0.9475 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7561   -0.0373   -0.6617 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5785   -0.4214    0.2893 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3448    1.6666   -0.4516 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4613   -0.0257   -1.2342 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4499   -1.6900   -0.5177 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3238   -0.2787    0.5701 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2610   -0.7915   -1.6312 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1364   -1.6292   -0.0675 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0885    0.4639    1.1717 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4063    0.9487   -2.1553 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0033    0.7249   -2.4885 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.3567   -0.5193    1.6435 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0282   -0.2816    1.9174 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.1813    0.1912   -1.6476 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.6543   -0.5029    0.0773 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.2998   -0.6743    1.2921 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8043    2.4277   -0.1363 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