Monomers

2-(4-Ethenylphenyl)propan-1-ol

Identifiers

IUPAC name
2-(4-ethenylphenyl)propan-1-ol
InchI
InChI=1S/C11H14O/c1-3-10-4-6-11(7-5-10)9(2)8-12/h3-7,9,12H,1,8H2,2H3
InchI Key
IWONVDRULKJRQP-UHFFFAOYSA-N
SMILES
OCC(c1ccc(cc1)C=C)C
Canonical SMILES
CC(CO)C1=CC=C(C=C1)C=C
Isomeric SMILES
CC(CO)C1=CC=C(C=C1)C=C
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
2.4254
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
   -1.9995    2.3009    0.3846 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4885    1.3341   -0.4600 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1319   -0.0754   -0.0466 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6577   -0.2544   -0.0072 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1251    0.4270    0.8992 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4965    0.2743    0.9510 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1381   -0.5734    0.0896 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3627   -1.2635   -0.8255 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0015   -1.1111   -0.8759 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5788   -0.7804    0.0907 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3927   -0.1742    0.9163 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7317   -0.4756    1.2585 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6897    3.0128    0.4673 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5726    1.4259   -0.6097 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0242    1.4841   -1.4744 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5422   -0.7433   -0.8562 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3949    1.1079    1.5907 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0270    0.8374    1.6808 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8568   -1.9365   -1.5118 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5632   -1.6703   -1.6068 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.0075   -1.4736   -0.6292 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.9977    0.5150    1.6374 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.4487   -0.3330    0.9091 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5283    0.2628    2.0503 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2813   -1.4445    1.5576 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8273   -0.6732    1.1397 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
  2 14  1  0
  2 15  1  0
  3 16  1  0
  5 17  1  0
  6 18  1  0
  8 19  1  0
  9 20  1  0
 10 21  1  0
 11 22  1  0
 11 23  1  0
 12 24  1  0
 12 25  1  0
 12 26  1  0
M  END

Similar Monomers

Structure
Similarity
IUPAC name
MF
Copolymers