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
   -2.3419   -1.1316    1.5933 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6146   -1.3101    0.2500 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0697   -0.2118   -0.6118 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5847   -0.1018   -0.4949 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0356    0.1899    0.7005 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4271    0.2952    0.8205 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2233    0.1033   -0.2871 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6184   -0.1948   -1.5165 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2471   -0.2868   -1.5801 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6710    0.1979   -0.2322 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3085    0.4703    0.8693 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7533    1.0866   -0.2707 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9217   -0.4247    1.9649 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7150   -1.3175    0.1243 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2241   -2.3033   -0.0369 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3238   -0.4518   -1.6647 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5328    0.3487    1.5930 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8534    0.5266    1.7866 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2345   -0.3499   -2.4046 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2528   -0.5184   -2.5270 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.2402    0.0336   -1.1515 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.8436    0.6474    1.8205 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.4117    0.5304    0.8552 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8437    0.8941   -0.2918 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5100    1.7995   -1.1043 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4260    1.4791    0.7049 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