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116570-49-1 | 1H-Indazol-6-ol, 3-chloro-
CAS No: 116570-49-1 Catalog No: AG000CT3 MDL No:
Product Description
Catalog Number:
AG000CT3
Chemical Name:
1H-Indazol-6-ol, 3-chloro-
CAS Number:
116570-49-1
Molecular Formula:
C7H5ClN2O
Molecular Weight:
168.5804
IUPAC Name:
3-chloro-2H-indazol-6-ol
InChI:
InChI=1S/C7H5ClN2O/c8-7-5-2-1-4(11)3-6(5)9-10-7/h1-3,11H,(H,9,10)
InChI Key:
JXVOJLPFEDCFKV-UHFFFAOYSA-N
SMILES:
Oc1ccc2c(c1)[nH]nc2Cl
Properties
Complexity:
155
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
168.009g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
168.58g/mol
Monoisotopic Mass:
168.009g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
48.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
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