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
    2.1871    1.1990   -1.1864 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0903   -0.0640   -1.5355 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6394   -1.2147   -0.7601 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9813   -0.9553    0.4985 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2766   -0.2565    0.5920 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4147   -1.0255    0.2664 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6885   -0.5156    0.3455 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9142    0.7819    0.7501 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8263    1.5599    1.0759 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5307    1.0159    0.9878 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5511    1.9646   -1.9039 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.9644    1.5969   -0.2233 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.4172   -0.2536   -2.6144 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.0623   -1.8575   -1.4815 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5851   -1.8392   -0.5792 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.8190   -1.9600    1.0154 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.7116   -0.4501    1.2177 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2982   -2.0578   -0.0599 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5682   -1.0929    0.0993 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8974    1.2031    0.8196 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9104    2.5941    1.4049 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.3163    1.6272    1.2710 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