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
   -4.0328   -0.1415   -0.5213 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6852    0.1208   -0.7772 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9425   -0.1530    0.5377 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5121    0.0879    0.3964 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2747   -0.6158   -0.4891 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6469   -0.3396   -0.5814 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2183    0.6286    0.2043 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4231    1.3515    1.1105 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0812    1.0565    1.1767 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6315    0.9000    0.0967 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3960    0.2544   -0.7268 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2838   -1.5720    0.9213 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5795   -0.0084   -1.3369 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5923    1.1681   -1.0906 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3446   -0.5893   -1.5521 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3762    0.5108    1.2930 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2078   -1.3648   -1.0864 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.1773   -0.9444   -1.3043 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8585    2.1169    1.7359 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4914    1.6445    1.8944 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.0547    1.6673    0.7271 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.0881   -0.5211   -1.3953 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.4718    0.4930   -0.7777 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2855   -1.5500    1.3996 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4035   -2.1848   -0.0035 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5852   -2.0156    1.6430 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