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10226-37-6 | 1H-Indazole-3-acetic acid, 5-methoxy-
CAS No: 10226-37-6 Catalog No: AG00072G MDL No:MFCD02929861
Product Description
Catalog Number:
AG00072G
Chemical Name:
1H-Indazole-3-acetic acid, 5-methoxy-
CAS Number:
10226-37-6
Molecular Formula:
C10H10N2O3
Molecular Weight:
206.1980
MDL Number:
MFCD02929861
IUPAC Name:
2-(5-methoxy-2H-indazol-3-yl)acetic acid
InChI:
InChI=1S/C10H10N2O3/c1-15-6-2-3-8-7(4-6)9(12-11-8)5-10(13)14/h2-4H,5H2,1H3,(H,11,12)(H,13,14)
InChI Key:
ALDYNZAFBDWYOF-UHFFFAOYSA-N
SMILES:
COc1cc2c(CC(=O)O)n[nH]c2cc1
Properties
Complexity:
247
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
206.069g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
206.201g/mol
Monoisotopic Mass:
206.069g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
75.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1
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