Home Other Building Blocks 2-AMINO-5H,7H,8H-PYRANO[4,3-B]PYRIDINE-3-CARBONITRILE

2-AMINO-5H,7H,8H-PYRANO[4,3-B]PYRIDINE-3-CARBONITRILE

CAS No.:
1250721-65-3
Catalog Number:
AG01DV46
Molecular Formula:
C9H9N3O
Molecular Weight:
175.1873
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Product Description
Catalog Number:
AG01DV46
Chemical Name:
2-AMINO-5H,7H,8H-PYRANO[4,3-B]PYRIDINE-3-CARBONITRILE
CAS Number:
1250721-65-3
Molecular Formula:
C9H9N3O
Molecular Weight:
175.1873
MDL Number:
MFCD16691185
IUPAC Name:
2-amino-7,8-dihydro-5H-pyrano[4,3-b]pyridine-3-carbonitrile
InChI:
InChI=1S/C9H9N3O/c10-4-6-3-7-5-13-2-1-8(7)12-9(6)11/h3H,1-2,5H2,(H2,11,12)
InChI Key:
XQFVNNPWOOKFLJ-UHFFFAOYSA-N
SMILES:
N#Cc1cc2COCCc2nc1N
Properties
Complexity:
234  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
175.075g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
175.191g/mol
Monoisotopic Mass:
175.075g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
71.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.5  
Properties