Home Carboxys 2H,3H-[1,4]dioxino[2,3-b]pyridine-6-carboxylic acid

2H,3H-[1,4]dioxino[2,3-b]pyridine-6-carboxylic acid

CAS No.:
1095276-23-5
Catalog Number:
AG01A345
Molecular Formula:
C8H7NO4
Molecular Weight:
181.1455
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
Product Description
Catalog Number:
AG01A345
Chemical Name:
2H,3H-[1,4]dioxino[2,3-b]pyridine-6-carboxylic acid
CAS Number:
1095276-23-5
Molecular Formula:
C8H7NO4
Molecular Weight:
181.1455
MDL Number:
MFCD18260625
IUPAC Name:
2,3-dihydro-[1,4]dioxino[2,3-b]pyridine-6-carboxylic acid
InChI:
InChI=1S/C8H7NO4/c10-8(11)5-1-2-6-7(9-5)13-4-3-12-6/h1-2H,3-4H2,(H,10,11)
InChI Key:
SQYSSECTRFWJFS-UHFFFAOYSA-N
SMILES:
OC(=O)c1ccc2c(n1)OCCO2
Properties
Complexity:
208  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
181.038g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
181.147g/mol
Monoisotopic Mass:
181.038g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
68.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8  
Properties