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
   -2.8262    1.4795    0.5082 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7072    0.8904   -0.7263 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8901   -0.3726   -0.7304 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5132   -0.1870   -0.2777 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2132    0.2719    0.9887 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0927    0.4209    1.3423 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1771    0.1374    0.4994 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8635   -0.3151   -0.7485 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5538   -0.4740   -1.1296 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5370    0.3293    0.9704 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5523    0.0706    0.1992 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6428   -1.4183    0.0806 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5659    2.1484    0.4442 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2795    1.6557   -1.4176 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7243    0.6715   -1.1016 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8785   -0.7486   -1.7732 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0474    0.4997    1.6645 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.3305    0.7848    2.3468 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.6314   -0.5560   -1.4573 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.3740   -0.8400   -2.1428 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.7227    0.7001    1.9968 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.4598   -0.2891   -0.8007 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.5548    0.2208    0.5706 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9261   -1.0675    1.0754 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5857   -1.6572   -0.4606 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0494   -2.3558    0.0793 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