4-((4-Ethyl-2,6-difluorphenyl)-ethinyl)-4'-propylbiphenyl

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Catalog Number
ACM221526723
Product Name
4-((4-Ethyl-2,6-difluorphenyl)-ethinyl)-4'-propylbiphenyl
Structure
Structure
CAS
221526-72-3
Category
Heterocyclic Organic Compound
Synonyms
4-((4-Ethyl-2,6-difluorphenyl)-ethinyl)-4′-propylbiphenyl;4-(4-ETHYL-2,6-DIFLUORO-PHENYLETHYNYL)-4''-PROPYL-BIPHENYL
IUPAC Name
5-ethyl-1,3-difluoro-2-[2-[4-(4-propylphenyl)phenyl]ethynyl]benzene
Molecular Weight
360.4g/mol
Molecular Formula
C25H22F2
Canonical SMILES
CCCC1=CC=C(C=C1)C2=CC=C(C=C2)C#CC3=C(C=C(C=C3F)CC)F
InChI
InChI=1S/C25H22F2/c1-3-5-19-6-11-21(12-7-19)22-13-8-20(9-14-22)10-15-23-24(26)16-18(4-2)17-25(23)27/h6-9,11-14,16-17H,3-5H2,1-2H3
InChI Key
BUVFXQQCFVZRSL-UHFFFAOYSA-N
Complexity
487
Covalently-Bonded Unit Count
1
Exact Mass
360.168957g/mol
Formal Charge
0
H-Bond Acceptor
2
H-Bond Donor
0
Heavy Atom Count
27
Monoisotopic Mass
360.168957g/mol
Rotatable Bond Count
6
XLogP3
7.9
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