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1167056-55-4 | 1H-Indazol-3-amine, 6-(phenylmethoxy)-
CAS No: 1167056-55-4 Catalog No: AG000D43 MDL No:MFCD11845613
Product Description
Catalog Number:
AG000D43
Chemical Name:
1H-Indazol-3-amine, 6-(phenylmethoxy)-
CAS Number:
1167056-55-4
Molecular Formula:
C14H13N3O
Molecular Weight:
239.2725
MDL Number:
MFCD11845613
IUPAC Name:
6-phenylmethoxy-1H-indazol-3-amine
InChI:
InChI=1S/C14H13N3O/c15-14-12-7-6-11(8-13(12)16-17-14)18-9-10-4-2-1-3-5-10/h1-8H,9H2,(H3,15,16,17)
InChI Key:
ROHXXLOQNTULLE-UHFFFAOYSA-N
SMILES:
Nc1n[nH]c2c1ccc(c2)OCc1ccccc1
Properties
Complexity:
268
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
239.106g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
239.278g/mol
Monoisotopic Mass:
239.106g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
63.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7
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