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Home > Fluorides > 1167056-42-9
1167056-42-9 | 1H-Indazole, 6-fluoro-4-(phenylmethoxy)-
CAS No: 1167056-42-9 Catalog No: AG000D30 MDL No:MFCD12405196
Product Description
Catalog Number:
AG000D30
Chemical Name:
1H-Indazole, 6-fluoro-4-(phenylmethoxy)-
CAS Number:
1167056-42-9
Molecular Formula:
C14H11FN2O
Molecular Weight:
242.2483
MDL Number:
MFCD12405196
IUPAC Name:
6-fluoro-4-phenylmethoxy-1H-indazole
InChI:
InChI=1S/C14H11FN2O/c15-11-6-13-12(8-16-17-13)14(7-11)18-9-10-4-2-1-3-5-10/h1-8H,9H2,(H,16,17)
InChI Key:
SXIXTDXCUTXRTQ-UHFFFAOYSA-N
SMILES:
Fc1cc(OCc2ccccc2)c2c(c1)[nH]nc2
Properties
Complexity:
271
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
242.086g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
242.253g/mol
Monoisotopic Mass:
242.086g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
37.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1
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