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
   -4.1071    0.1904    0.5556 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6685   -0.2208    0.8286 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8146    0.3415   -0.2425 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3908    0.0517   -0.1515 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1767   -0.8907    0.6688 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5051   -1.1567    0.7496 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3932   -0.4407   -0.0438 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8735    0.5160   -0.8839 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4931    0.7626   -0.9396 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.8122   -0.7473    0.0636 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.7267   -0.1291   -0.6397 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9962    1.7439   -0.2392 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6783    0.3349    1.4979 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6100   -0.5293   -0.1353 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1372    1.1892    0.0336 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6574   -1.3012    0.9370 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3709    0.2159    1.8204 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2036    0.0091   -1.2380 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4915   -1.4610    1.2958 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8900   -1.9145    1.4186 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5566    1.0742   -1.5014 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.1819    1.5284   -1.6257 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.1207   -1.5269    0.7623 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.4628    0.6348   -1.3294 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.7633   -0.3957   -0.5209 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8299    2.1212    0.6585 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