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
    4.0330   -0.3532   -0.4374 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5923    0.1416   -0.5685 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7643   -0.7600    0.3286 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3317   -0.4036    0.3094 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4799   -0.9637    1.2733 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8168   -0.7082    1.3541 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4246    0.1506    0.4406 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6136    0.7088   -0.5207 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2522    0.4339   -0.5840 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8503    0.4284    0.5200 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4218    1.2302   -0.3311 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3265   -0.7238    1.5912 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.6866    0.0855   -1.2113 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.0066   -1.4489   -0.4344 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.3616   -0.0347    0.5862 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2677    0.0843   -1.6278 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5249    1.2076   -0.2784 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8927   -1.7918   -0.0612 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0397   -1.6486    2.0153 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4475   -1.1490    2.1103 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0193    1.3911   -1.2698 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.3474    0.8887   -1.3486 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4224   -0.0413    1.2950 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9545    1.7596   -1.1505 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.5065    1.4015   -0.2197 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.1139    0.1150    2.0758 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