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1342703-44-9 | Cyclohexyl (4-bromo-2-fluorophenyl)methanol
CAS No: 1342703-44-9 Catalog No: AG01FAX5 MDL No:
Product Description
Catalog Number:
AG01FAX5
Chemical Name:
Cyclohexyl (4-bromo-2-fluorophenyl)methanol
CAS Number:
1342703-44-9
Molecular Formula:
C13H16BrFO
Molecular Weight:
287.1679
IUPAC Name:
(4-bromo-2-fluorophenyl)-cyclohexylmethanol
InChI:
InChI=1S/C13H16BrFO/c14-10-6-7-11(12(15)8-10)13(16)9-4-2-1-3-5-9/h6-9,13,16H,1-5H2
InChI Key:
ZEMIKZISKUASGA-UHFFFAOYSA-N
SMILES:
Brc1ccc(c(c1)F)C(C1CCCCC1)O
Properties
Complexity:
218
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
286.037g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
287.172g/mol
Monoisotopic Mass:
286.037g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
4.2
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