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
   -2.9146    0.4451   -0.6850 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7827   -0.6301    0.3832 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6114   -1.5587    0.0414 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3421   -0.8028   -0.0273 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2907   -0.6115   -1.2387 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4774    0.0893   -1.3395 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0893    0.6382   -0.2013 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4591    0.4465    0.9980 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2899   -0.2494    1.0630 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3329    1.3622   -0.3728 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.9536    1.8962    0.6373 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5069   -2.4445    1.1301 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9037    0.8061   -1.0110 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4996    0.0886   -1.5451 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4274    1.3435   -0.2837 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6510   -0.2206    1.3907 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7361   -1.1950    0.3661 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7844   -2.0947   -0.8969 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1530   -1.0219   -2.1431 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.9739    0.2406   -2.2828 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8861    0.8453    1.8928 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1719   -0.3758    2.0311 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.7456    1.4555   -1.3627 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.8736    2.4274    0.4821 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.5676    1.8195    1.6300 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4550   -2.6988    1.3441 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