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
    3.2852   -0.8679   -0.5960 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9853    0.4768   -0.0125 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7427    1.1296   -0.4535 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4735    0.4832   -0.2012 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6687    1.2093   -0.5459 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9430    0.6940   -0.3416 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1445   -0.5479    0.2064 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9997   -1.2777    0.5530 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2305   -0.7493    0.3422 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4549   -1.1459    0.4466 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5440   -0.5186    0.1466 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7072    2.4351    0.0851 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.5009   -1.2522   -1.2775 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.2924   -0.8791   -1.1152 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4104   -1.6017    0.2226 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.1204    0.4382    1.0905 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.8325    1.1597   -0.3332 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8070    1.2608   -1.5847 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5869    2.2001   -0.9847 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8137    1.2941   -0.6251 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1593   -2.2682    0.9901 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.0940   -1.3310    0.6251 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5317   -2.1485    0.8907 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5584    0.4620   -0.2894 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.5183   -0.9932    0.3385 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.4412    2.3382    1.0278 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