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102735-90-0 | 1H-Indazole-3-methanol, 5-chloro-
CAS No: 102735-90-0 Catalog No: AG00088Y MDL No:MFCD11707247
Product Description
Catalog Number:
AG00088Y
Chemical Name:
1H-Indazole-3-methanol, 5-chloro-
CAS Number:
102735-90-0
Molecular Formula:
C8H7ClN2O
Molecular Weight:
182.6070
MDL Number:
MFCD11707247
IUPAC Name:
(5-chloro-2H-indazol-3-yl)methanol
InChI:
InChI=1S/C8H7ClN2O/c9-5-1-2-7-6(3-5)8(4-12)11-10-7/h1-3,12H,4H2,(H,10,11)
InChI Key:
YBUIOIPQDAOQHA-UHFFFAOYSA-N
SMILES:
OCc1n[nH]c2c1cc(Cl)cc2
Properties
Complexity:
167
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
182.025g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
182.607g/mol
Monoisotopic Mass:
182.025g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
48.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3
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