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
   -4.0236   -0.5389    1.0288 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6716   -0.8749    0.9119 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9493    0.3448    0.4060 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5161    0.1515    0.2304 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3630    0.9489    0.9209 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7304    0.8208    0.8024 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2521   -0.1368   -0.0346 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3569   -0.9527   -0.7412 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0040   -0.8110   -0.6109 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6790   -0.3050   -0.1883 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5822    0.4154    0.4351 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5367    0.7430   -0.9425 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6146   -1.1387    0.5316 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2299   -1.1709    1.8723 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5467   -1.7048    0.1782 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1370    1.1607    1.1182 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0075    1.7307    1.6040 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.3638    1.5021    1.3930 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.7419   -1.7135   -1.4060 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7124   -1.4233   -1.1409 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.9965   -1.0975   -0.8805 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.6355    0.2408    0.2777 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.2907    1.1878    1.1097 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9073    0.3151   -1.7324 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5239    1.8528   -1.0651 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6115    0.4538   -1.0216 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