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
   -2.4257   -1.1422    2.0366 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7491   -0.8818    0.7227 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1284    0.3668    0.1736 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6514    0.3407    0.2074 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0199    1.3694    0.8414 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3932    1.3883    0.8986 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1528    0.3650    0.3157 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4921   -0.6692   -0.3212 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0930   -0.6613   -0.3633 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6027    0.4400    0.4088 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3581   -0.4935   -0.1213 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5427    0.4761   -1.2850 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2955   -2.1373    2.1429 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5045   -1.7283    0.0314 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8513   -0.7535    0.6728 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5346    1.2534    0.6867 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5023    2.1998    1.3175 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.9405    2.1844    1.3901 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0145   -1.4769   -0.7839 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4362   -1.4631   -0.8576 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.0415    1.2962    0.9330 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.9378   -1.3253   -0.6303 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.4565   -0.4440   -0.0551 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4229   -0.1561   -1.5079 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7314    0.1134   -1.9609 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7266    1.5392   -1.5754 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