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1000341-23-0 | 1H-Indazol-4-amine, 3-bromo-6-methoxy-
CAS No: 1000341-23-0 Catalog No: AG0000FQ MDL No:
Product Description
Catalog Number:
AG0000FQ
Chemical Name:
1H-Indazol-4-amine, 3-bromo-6-methoxy-
CAS Number:
1000341-23-0
Molecular Formula:
C8H8BrN3O
Molecular Weight:
242.0726
IUPAC Name:
3-bromo-6-methoxy-2H-indazol-4-amine
InChI:
InChI=1S/C8H8BrN3O/c1-13-4-2-5(10)7-6(3-4)11-12-8(7)9/h2-3H,10H2,1H3,(H,11,12)
InChI Key:
XDZZLJIQVKVFFM-UHFFFAOYSA-N
SMILES:
COc1cc(N)c2c(c1)[nH]nc2Br
Properties
Complexity:
192
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
240.985g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
242.076g/mol
Monoisotopic Mass:
240.985g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
63.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
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