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
    4.3641    1.0850    0.5703 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7159    0.0739    0.0548 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2711   -0.1035    0.1941 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4600    0.7754    0.8793 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0825    0.5395    0.9707 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4963   -0.5451    0.3979 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3257   -1.4150   -0.2836 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6846   -1.2247   -0.4001 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9429   -0.8613    0.4515 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7060   -0.2577   -0.6985 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0534   -0.6357   -0.5212 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6919    1.2577   -0.6473 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.8578    1.8474    1.1307 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.4371    1.1439    0.4216 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.2866   -0.6773   -0.5098 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8945    1.6466    1.3447 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5035    1.2399    1.5063 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0858   -2.3059   -0.7652 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.3318   -1.9063   -0.9346 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1034   -1.9575    0.4230 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3438   -0.4268    1.3882 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3880   -0.6468   -1.6663 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2153   -1.5259   -0.9685 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8999    1.6317   -1.2966 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6686    1.6780   -1.0246 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6131    1.5705    0.4112 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