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
   -2.4979    1.5686    0.4316 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7183    0.6713   -0.7713 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0894   -0.7027   -0.5304 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6276   -0.5792   -0.2989 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1152   -0.2517    0.9345 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2552   -0.1262    1.1907 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1530   -0.3350    0.1786 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6632   -0.6649   -1.0692 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3094   -0.7834   -1.2998 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5868   -0.2297    0.3414 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.1096    0.0780    1.4953 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7443   -1.4071    0.4493 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4539    1.8679    0.5509 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1579    2.4539    0.3225 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8561    1.0356    1.3405 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8163    0.5668   -0.8834 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3203    1.1230   -1.6758 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2574   -1.2577   -1.4958 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7748   -0.0701    1.7929 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.5821    0.1371    2.1982 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.3642   -0.8315   -1.8740 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0809   -1.0454   -2.2905 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.2482   -0.4145   -0.5319 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4985    0.2596    2.3460 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.1983    0.1464    1.5719 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4579   -1.2090    1.3657 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