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1216279-49-0 | Cyclohexyl (2,5-difluorophenyl)methanol
CAS No: 1216279-49-0 Catalog No: AG01FC8F MDL No:
Product Description
Catalog Number:
AG01FC8F
Chemical Name:
Cyclohexyl (2,5-difluorophenyl)methanol
CAS Number:
1216279-49-0
Molecular Formula:
C13H16F2O
Molecular Weight:
226.2623
IUPAC Name:
cyclohexyl-(2,5-difluorophenyl)methanol
InChI:
InChI=1S/C13H16F2O/c14-10-6-7-12(15)11(8-10)13(16)9-4-2-1-3-5-9/h6-9,13,16H,1-5H2
InChI Key:
JRACLUBFFSQQPO-UHFFFAOYSA-N
SMILES:
OC(c1cc(F)ccc1F)C1CCCCC1
Properties
Complexity:
216
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
226.117g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
226.267g/mol
Monoisotopic Mass:
226.117g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6
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