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
   -4.0328   -0.7993    0.1644 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5274   -0.8339   -0.0122 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8740    0.3769    0.6065 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4108    0.3575    0.4403 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3387    1.5030    0.6654 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7050    1.4915    0.5114 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4130    0.3447    0.1249 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6525   -0.7796   -0.0933 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2607   -0.7663    0.0641 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.8580    0.4041   -0.0187 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5556   -0.6426   -0.3772 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4151    1.5038    0.0087 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3167   -0.3976    1.1729 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5241   -0.1401   -0.5751 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4674   -1.8114    0.0469 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2023   -1.7889    0.4816 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3265   -0.8633   -1.0978 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0870    0.4039    1.7012 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1677    2.4095    0.9650 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.3052    2.3976    0.6886 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.1438   -1.7021   -0.3955 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2687   -1.6832   -0.1244 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.3718    1.3327    0.1742 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.6438   -0.5952   -0.4846 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.1312   -1.6077   -0.5898 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7588    1.8858   -0.6306 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