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865887-07-6 | Methyl 4-methoxy-1H-indazole-3-carboxylate
CAS No: 865887-07-6 Catalog No: AG004LEP MDL No:MFCD07371614
Product Description
Catalog Number:
AG004LEP
Chemical Name:
Methyl 4-methoxy-1H-indazole-3-carboxylate
CAS Number:
865887-07-6
Molecular Formula:
C10H10N2O3
Molecular Weight:
206.1980
MDL Number:
MFCD07371614
IUPAC Name:
methyl 4-methoxy-1H-indazole-3-carboxylate
InChI:
InChI=1S/C10H10N2O3/c1-14-7-5-3-4-6-8(7)9(12-11-6)10(13)15-2/h3-5H,1-2H3,(H,11,12)
InChI Key:
QHTKTZDEOKQZJO-UHFFFAOYSA-N
SMILES:
COC(=O)c1n[nH]c2c1c(OC)ccc2
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:
1
Isotope Atom Count:
0
Molecular Weight:
206.201g/mol
Monoisotopic Mass:
206.069g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
64.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7
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