Monomers

1-(4-Vinylphenyl)-2-propanol

Identifiers

IUPAC name
1-(4-ethenylphenyl)propan-2-ol
InchI
InChI=1S/C11H14O/c1-3-10-4-6-11(7-5-10)8-9(2)12/h3-7,9,12H,1,8H2,2H3
InchI Key
LLWNVRSHEMAPGD-UHFFFAOYSA-N
SMILES
C=Cc1ccc(cc1)CC(O)C
Canonical SMILES
CC(CC1=CC=C(C=C1)C=C)O
Isomeric SMILES
CC(CC1=CC=C(C=C1)C=C)O
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
2.2529
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
    4.5771    0.0683    0.9522 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.8714   -0.0958   -0.1150 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4336   -0.2463   -0.0855 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7087   -0.4222   -1.2703 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3474   -0.5653   -1.2503 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3848   -0.5458   -0.0837 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3264   -0.3731    1.0795 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7203   -0.2248    1.0800 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8611   -0.7030   -0.0873 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5579    0.6361   -0.2052 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2484    1.4849    0.8337 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0384    0.4188   -0.3111 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.6707    0.1782    0.8757 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.1511    0.1047    1.9304 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.3702   -0.1237   -1.0839 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2841   -0.4381   -2.1935 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1852   -0.7005   -2.1911 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2042   -0.3520    2.0080 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2163   -0.0918    2.0412 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1806   -1.2369    0.8326 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1320   -1.3652   -0.9340 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2099    1.1148   -1.1458 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3552    2.4327    0.5619 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6132    1.3237    0.0106 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3671   -0.4475    0.3091 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3395    0.1697   -1.3547 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  3
  2  3  1  0
  3  4  2  0
  4  5  1  0
  5  6  2  0
  6  7  1  0
  7  8  2  0
  6  9  1  0
  9 10  1  0
 10 11  1  0
 10 12  1  0
  8  3  1  0
  1 13  1  0
  1 14  1  0
  2 15  1  0
  4 16  1  0
  5 17  1  0
  7 18  1  0
  8 19  1  0
  9 20  1  0
  9 21  1  0
 10 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