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
    4.3613    0.3895    0.7244 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4966   -0.5957    0.6659 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1587   -0.3582    0.1515 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2345   -1.4144    0.0897 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0398   -1.2475   -0.3859 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4885   -0.0247   -0.8335 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3991    1.0284   -0.7835 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6883    0.8541   -0.3010 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8682    0.1702   -1.3519 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8280    0.5568   -0.2398 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4267    1.7395    0.3604 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9497   -0.5469    0.7999 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.3848    0.2153    1.1162 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.1823    1.4049    0.4189 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.7708   -1.5830    0.9973 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.5867   -2.3946    0.4459 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7412   -2.0713   -0.4275 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0580    1.9925   -1.1321 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.3416    1.6945   -0.2799 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9288    0.9802   -2.1073 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2224   -0.7772   -1.7664 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8119    0.7402   -0.7191 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3474    1.6074    1.3203 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0687   -1.5280    0.3387 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0881   -0.5328    1.4871 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8533   -0.2992    1.4116 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