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
   -2.9651   -0.8463    0.5552 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8451    0.2543   -0.4761 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7989    1.2777   -0.0417 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4700    0.6566    0.1188 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0846   -0.0445    1.2419 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1665   -0.5996    1.3301 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1003   -0.4858    0.3044 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7385    0.2084   -0.8243 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4559    0.7626   -0.8839 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4174   -1.0816    0.4208 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2977   -0.9856   -0.5228 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2083    1.9650    1.0925 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1258   -0.4411    1.5852 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0700   -1.4901    0.4832 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9095   -1.4090    0.3220 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4895   -0.2163   -1.4093 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8097    0.7542   -0.5922 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7428    2.0206   -0.8630 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7880   -0.1451    2.0452 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.4801   -1.1561    2.2148 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.4267    0.3253   -1.6486 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.2231    1.2955   -1.7884 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.6342   -1.6216    1.3537 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.1834   -0.4879   -1.4551 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.2799   -1.4606   -0.3725 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0964    2.9508    0.9907 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