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PubChem ID: 634413
2-[4-(4-heptylphenyl)phenyl]-5-hexylpyrimidine
Compound Details
Synonymous names
Pyrimidine, 2-(4'-heptyl[1,1'-biphenyl]-4-yl)-5-hexyl-
92519-52-3
SCHEMBL9227943
DTXSID60348293
MBHGALQIQUJELF-UHFFFAOYSA-N
2-(4'-Heptyl-biphenyl-4-yl)-5-hexyl-pyrimidine
2-(4'-Heptyl[1,1'-biphenyl]-4-yl)-5-hexylpyrimidine #
Microorganism:
No
IUPAC name
2-[4-(4-heptylphenyl)phenyl]-5-hexylpyrimidine
SMILES
CCCCCCCC1=CC=C(C=C1)C2=CC=C(C=C2)C3=NC=C(C=N3)CCCCCC
Inchi
InChI=1S/C29H38N2/c1-3-5-7-9-11-12-24-14-16-26(17-15-24)27-18-20-28(21-19-27)29-30-22-25(23-31-29)13-10-8-6-4-2/h14-23H,3-13H2,1-2H3
Formula
C
2
9
H
3
8
N
2
PubChem ID
634413
Molweight
414.6
LogP
10
Atoms
31
Bonds
13
H-bond Acceptor
2
H-bond Donor
0
Chemical Classification
aromatic compounds
benzenoids
heterocyclic compounds
nitrogen compounds
pyrimidines
mVOC Specific Details
Species emitting the compound
Kingdom
Species
Biological Function
Origin/Habitat
Reference
Aspergillus Flavus
Kate et al. 2023
Method
Kingdom
Species
Growth Medium
Applied Method
Verification
Aspergillus Flavus
inoculated potato samples
GC-MS
no