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Home > Fluorides > 189750-98-9
189750-98-9 | 4-Ethoxy-2,3-difluoro-4'-(trans-4-propylcyclohexyl)-1,1'-biphenyl
CAS No: 189750-98-9 Catalog No: AG003KAT MDL No:MFCD18451991
Product Description
Catalog Number:
AG003KAT
Chemical Name:
4-Ethoxy-2,3-difluoro-4'-(trans-4-propylcyclohexyl)-1,1'-biphenyl
CAS Number:
189750-98-9
Molecular Formula:
C23H28F2O
Molecular Weight:
358.4646
MDL Number:
MFCD18451991
IUPAC Name:
1-ethoxy-2,3-difluoro-4-[4-(4-propylcyclohexyl)phenyl]benzene
InChI:
InChI=1S/C23H28F2O/c1-3-5-16-6-8-17(9-7-16)18-10-12-19(13-11-18)20-14-15-21(26-4-2)23(25)22(20)24/h10-17H,3-9H2,1-2H3
InChI Key:
IBFAIOMGVHPWRQ-UHFFFAOYSA-N
SMILES:
CCC[C@@H]1CC[C@H](CC1)c1ccc(cc1)c1ccc(c(c1F)F)OCC
EC Number:
921-136-5
Properties
Complexity:
399
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
358.211g/mol
Formal Charge:
0
Heavy Atom Count:
26
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
358.473g/mol
Monoisotopic Mass:
358.211g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
9.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
8
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