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
   -4.0497   -0.6847   -0.2716 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6291   -0.6025    0.2963 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7737   -0.0151   -0.8060 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3541    0.1259   -0.3962 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0849    1.1743    0.3672 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4011    1.2832    0.7334 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3758    0.3479    0.3609 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9296   -0.7029   -0.4057 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5835   -0.8070   -0.7756 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7447    0.5398    0.7916 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6794   -0.3015    0.4691 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3195    1.1775   -1.2665 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5593   -1.5850    0.1503 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0177   -0.7336   -1.3840 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5602    0.2419    0.0246 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5897   -0.0463    1.2314 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3331   -1.6502    0.4993 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8171   -0.7384   -1.6633 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6071    1.9407    0.6966 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.7488    2.1061    1.3334 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.6206   -1.4670   -0.7338 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.2395   -1.6397   -1.3809 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.0018    1.3964    1.3927 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.4640   -1.1623   -0.1253 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.7068   -0.1737    0.7820 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9701    1.9761   -0.8208 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