Monomers

1-(4-Vinylphenyl)-2-propanol

Identifiers

IUPAC name
1-(4-ethenylphenyl)propan-2-ol
InchI
InChI=1S/C11H14O/c1-3-10-4-6-11(7-5-10)8-9(2)12/h3-7,9,12H,1,8H2,2H3
InchI Key
LLWNVRSHEMAPGD-UHFFFAOYSA-N
SMILES
C=Cc1ccc(cc1)CC(O)C
Canonical SMILES
CC(CC1=CC=C(C=C1)C=C)O
Isomeric SMILES
CC(CC1=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
2.2529
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
    4.4913   -0.4912   -0.3578 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5161   -0.8485    0.4513 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1658   -0.3127    0.3995 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2204   -0.7603    1.2989 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0764   -0.2934    1.3034 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4786    0.6523    0.3939 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4412    1.1140   -0.5108 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7589    0.6396   -0.5154 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8571    1.1327    0.4165 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8026    0.3455   -0.4478 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3694    0.4035   -1.7684 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9980   -1.0721    0.0179 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3382    0.2489   -1.1362 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.4557   -0.9421   -0.2432 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.7326   -1.5899    1.2051 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.4972   -1.5199    2.0484 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7638   -0.7057    2.0563 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.1499    1.8681   -1.2481 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.4711    1.0116   -1.2325 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2703    1.1711    1.4554 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8791    2.1806    0.0526 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7924    0.8521   -0.3897 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7253    1.2490   -2.1669 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0267   -1.3861   -0.2562 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9225   -1.1725    1.1201 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2763   -1.7744   -0.4492 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  3
  2  3  1  0
  3  4  2  0
  4  5  1  0
  5  6  2  0
  6  7  1  0
  7  8  2  0
  6  9  1  0
  9 10  1  0
 10 11  1  0
 10 12  1  0
  8  3  1  0
  1 13  1  0
  1 14  1  0
  2 15  1  0
  4 16  1  0
  5 17  1  0
  7 18  1  0
  8 19  1  0
  9 20  1  0
  9 21  1  0
 10 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