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
   -3.8788   -0.7175    0.9884 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5104   -0.6243    0.9105 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0243   -0.3044   -0.4987 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5416   -0.2343   -0.4339 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2011   -1.1226   -1.1852 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5740   -1.0636   -1.1302 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2320   -0.1377   -0.3419 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5144    0.7532    0.4118 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1210    0.6794    0.3441 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6770   -0.1058   -0.3097 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3715    0.7400    0.4109 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5986    0.9790   -1.0143 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3357   -0.7497    0.1073 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1195    0.1389    1.6101 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0477   -1.6243    1.1553 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2939   -1.1206   -1.1924 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2959   -1.8663   -1.8183 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.1356   -1.7876   -1.7427 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.9635    1.5195    1.0638 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4804    1.3819    0.9383 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.2151   -0.8321   -0.9242 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.9436    1.4862    1.0428 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.4633    0.7166    0.3949 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6087    1.7823   -0.2429 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6500    0.8358   -1.3322 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0268    1.2778   -1.9138 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