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
   -3.8853   -0.2120   -1.1881 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3935    0.0340   -1.0104 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8901   -0.5222    0.2865 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4259   -0.2527    0.3990 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2559    0.5738   -0.4695 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6018    0.8250   -0.3688 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3522    0.2497    0.6278 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6703   -0.5896    1.5131 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3243   -0.8419    1.4138 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7903    0.4792    0.7866 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5017    1.2476    0.0043 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1155   -1.8830    0.4272 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4736    0.4206   -0.5108 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1168    0.1431   -2.2340 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1477   -1.2698   -1.1530 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8103   -0.2995   -1.8703 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2982    1.1464   -0.9554 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4250   -0.0212    1.1368 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2992    1.0459   -1.2695 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0883    1.4774   -1.0707 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2480   -1.0488    2.3017 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1911   -1.5003    2.1144 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.2630   -0.0506    1.6343 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.0422    1.7566   -0.8119 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.5602    1.3428    0.2180 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2259   -2.2506   -0.4981 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