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
   -2.7753    0.1806    1.5348 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8623    0.7323    0.2742 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0204   -0.0030   -0.7563 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5805    0.0131   -0.3767 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1896   -0.6349    0.7667 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1384   -0.6262    1.1276 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1021    0.0318    0.3507 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6600    0.6636   -0.7814 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3327    0.6582   -1.1475 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4672   -0.0035    0.7923 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.4370    0.5724    0.1492 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4532   -1.4225   -0.9560 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6087    0.8961    2.2027 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4807    1.7917    0.2635 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8988    0.7906   -0.0912 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1495    0.5557   -1.7169 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8713   -1.1653    1.4191 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.4537   -1.1456    2.0446 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.4069    1.1808   -1.3952 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0548    1.1741   -2.0483 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.7275   -0.5349    1.7117 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.2569    1.1090   -0.7560 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.4592    0.5364    0.4950 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0910   -2.0716   -0.1310 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9622   -1.7913   -1.8829 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5529   -1.4876   -1.0926 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