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
    4.5720   -0.6206   -0.4328 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.8407    0.4047   -0.0913 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4171    0.2448    0.1669 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6482    1.3568    0.5324 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3077    1.2426    0.7824 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3651    0.0445    0.6927 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3712   -1.0590    0.3354 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7376   -0.9458    0.0799 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8210   -0.0363    0.9724 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5423    0.2053   -0.3528 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1761   -0.7517   -1.2741 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0203    0.2133   -0.0669 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.1636   -1.5954   -0.5339 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.6261   -0.4742   -0.6187 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.2562    1.4126    0.0146 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.1433    2.3128    0.6124 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2918    2.1242    1.0701 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1040   -2.0183    0.2507 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2683   -1.8614   -0.2003 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0251   -1.0794    1.2884 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1493    0.6709    1.7426 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2785    1.1954   -0.7707 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4521   -1.6520   -0.9316 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2218   -0.4296    0.8270 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3007    1.2400    0.2340 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6039   -0.1443   -0.9522 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