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
    3.0285    1.2519    0.1757 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9259   -0.2019   -0.1866 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8803   -0.9718    0.5095 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4874   -0.5491    0.3229 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0435    0.5260   -0.3601 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3222    0.7881   -0.4305 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2710    0.0114    0.1595 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8110   -1.1056    0.8688 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4634   -1.3693    0.9419 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7025    0.2363    0.1190 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1769    1.2736   -0.5357 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9890   -2.3210    0.1820 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.2702    1.5668    0.9132 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9945    1.8720   -0.7394 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.0159    1.4935    0.6519 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9120   -0.3457   -1.3045 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.9131   -0.6774    0.0997 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0737   -0.9101    1.6132 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.7397    1.1605   -0.8441 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6302    1.6627   -0.9898 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5430   -1.7534    1.3563 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1485   -2.2594    1.5110 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4071   -0.4267    0.6144 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5701    1.9852   -1.0560 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.2556    1.4172   -0.5491 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0279   -2.3537   -0.8209 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