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
   -2.4473   -1.6739    0.7913 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6033   -0.4069    1.3513 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9820    0.6539    0.4777 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5429    0.4558    0.2723 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3772    1.3843    0.6937 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7370    1.2317    0.5178 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2365    0.1080   -0.1061 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3230   -0.8314   -0.5336 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0560   -0.6589   -0.3459 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6662   -0.0489   -0.2892 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2341   -1.0714   -0.8652 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7567    0.6811   -0.8194 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0016   -1.7326   -0.0476 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6900   -0.2424    1.4609 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1744   -0.4425    2.3636 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1328    1.6235    0.9950 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0615    2.3029    1.1971 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.4561    1.9695    0.8535 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6811   -1.7244   -1.0266 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6778   -1.4575   -0.7203 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.3144    0.7428    0.0799 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.2980   -1.1178   -0.9646 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.6468   -1.8741   -1.2445 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2429    0.1580   -1.6364 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9494    1.7410   -1.1404 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7749    0.2301   -0.7070 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