Home Other Building Blocks Methyl 5,6-dihydroxynicotinate

Methyl 5,6-dihydroxynicotinate

CAS No.:
1363382-77-7
Catalog Number:
AG0011R1
Molecular Formula:
C7H7NO4
Molecular Weight:
169.1348
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
97%
1 week
United States
$344
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Product Description
Catalog Number:
AG0011R1
Chemical Name:
Methyl 5,6-dihydroxynicotinate
CAS Number:
1363382-77-7
Molecular Formula:
C7H7NO4
Molecular Weight:
169.1348
MDL Number:
MFCD23105855
IUPAC Name:
methyl 5-hydroxy-6-oxo-1H-pyridine-3-carboxylate
InChI:
InChI=1S/C7H7NO4/c1-12-7(11)4-2-5(9)6(10)8-3-4/h2-3,9H,1H3,(H,8,10)
InChI Key:
GKUFHKYBUJMWSL-UHFFFAOYSA-N
SMILES:
COC(=O)c1c[nH]c(=O)c(c1)O
Properties
Complexity:
290  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
169.038g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
169.136g/mol
Monoisotopic Mass:
169.038g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
75.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.4  
Properties