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1000340-45-3 | 1H-Indazol-5-amine, 3-chloro-4-fluoro-
CAS No: 1000340-45-3 Catalog No: AG0000DP MDL No:
Product Description
Catalog Number:
AG0000DP
Chemical Name:
1H-Indazol-5-amine, 3-chloro-4-fluoro-
CAS Number:
1000340-45-3
Molecular Formula:
C7H5ClFN3
Molecular Weight:
185.5861
IUPAC Name:
3-chloro-4-fluoro-2H-indazol-5-amine
InChI:
InChI=1S/C7H5ClFN3/c8-7-5-4(11-12-7)2-1-3(10)6(5)9/h1-2H,10H2,(H,11,12)
InChI Key:
RTQQQRYQVGMXJF-UHFFFAOYSA-N
SMILES:
Nc1ccc2c(c1F)c(Cl)n[nH]2
Properties
Complexity:
180
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
185.016g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
185.586g/mol
Monoisotopic Mass:
185.016g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
54.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
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