Monomers

4-Phenyl-1-butene

Identifiers

IUPAC name
but-3-enylbenzene
InchI
InChI=1S/C10H12/c1-2-3-7-10-8-5-4-6-9-10/h2,4-6,8-9H,1,3,7H2
InchI Key
PBGVMIDTGGTBFS-UHFFFAOYSA-N
SMILES
C=CCCc1ccccc1
Canonical SMILES
C=CCCC1=CC=CC=C1
Isomeric SMILES
C=CCCC1=CC=CC=C1
Resources
cid=

Structures

2D Structure
3D Structure

Molecular Formula and Computed Descriptors

Molecular Formula
C10H12
Heavy Atom Count
10
Molecular Weight
132.206
Exact Molecular Weight
132.0939
Valence Electrons
52
Radical Electrons
0
tPSA
0.0
MolLogP
2.8052
H Bond Acceptors
0
H Bond Donors
0
Aliphatic Carbocycles
0
Aromatic Carbocycles
1
Aliphatic Heterocycles
0
Aromatic Heterocycles
0
Aliphatic Rings
0
Aromatic Rings
1

MOL File


     RDKit          3D

 22 22  0  0  0  0  0  0  0  0999 V2000
    3.1970    1.1736    0.3226 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0627    0.5517    0.5323 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8226   -0.8339    0.0529 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6716   -0.9285   -0.8912 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6147   -0.5031   -0.3605 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9577    0.8270   -0.5081 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1448    1.3526   -0.0500 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0198    0.4972    0.5829 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7340   -0.8367    0.7594 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5296   -1.3126    0.2811 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3469    2.1721    0.6776 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.0320    0.7232   -0.2112 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.2596    1.0705    1.0813 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.7339   -1.1579   -0.4914 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.7424   -1.4757    0.9420 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.5686   -1.9990   -1.2101 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.9088   -0.3221   -1.7886 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2889    1.5465   -1.0074 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3983    2.4097   -0.1767 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9555    0.9088    0.9446 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4208   -1.5095    1.2565 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2822   -2.3538    0.4069 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  3
  2  3  1  0
  3  4  1  0
  4  5  1  0
  5  6  2  0
  6  7  1  0
  7  8  2  0
  8  9  1  0
  9 10  2  0
 10  5  1  0
  1 11  1  0
  1 12  1  0
  2 13  1  0
  3 14  1  0
  3 15  1  0
  4 16  1  0
  4 17  1  0
  6 18  1  0
  7 19  1  0
  8 20  1  0
  9 21  1  0
 10 22  1  0
M  END

Similar Monomers

Structure
Similarity
IUPAC name
MF
Copolymers