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
   -2.5149    0.8801    0.6841 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2782    0.0899   -0.3489 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7174   -1.2758   -0.1871 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3995   -1.4348   -0.9072 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6167   -0.4735   -0.3882 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7787    0.7841   -0.9243 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7115    1.6656   -0.4475 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5196    1.2878    0.6052 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3948    0.0365    1.1765 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4426   -0.8201    0.6656 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9195    1.8587    0.5324 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3143    0.5792    1.7094 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5036    0.4592   -1.3396 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4109   -2.0728   -0.5224 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5493   -1.4533    0.8956 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0012   -2.4472   -0.6937 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4815   -1.3388   -1.9892 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.1528    1.0848   -1.7443 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8396    2.6717   -0.8780 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2717    1.9831    0.9983 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.0328   -0.2509    2.0016 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.3269   -1.8132    1.1017 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