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Home Other Building Blocks 1(2H)-Isoquinolinone, 7-(4-pyridinyl)-

1(2H)-Isoquinolinone, 7-(4-pyridinyl)-

CAS No.:
1417640-16-4
Catalog Number:
AG001H0A
Molecular Formula:
C14H10N2O
Molecular Weight:
222.2420
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
100mg
95%
In Stock USA
United States
$509
- +
250mg
95%
In Stock USA
United States
$848
- +
Product Description
Catalog Number:
AG001H0A
Chemical Name:
1(2H)-Isoquinolinone, 7-(4-pyridinyl)-
CAS Number:
1417640-16-4
Molecular Formula:
C14H10N2O
Molecular Weight:
222.2420
MDL Number:
MFCD17926326
IUPAC Name:
7-pyridin-4-yl-2H-isoquinolin-1-one
InChI:
InChI=1S/C14H10N2O/c17-14-13-9-12(10-3-6-15-7-4-10)2-1-11(13)5-8-16-14/h1-9H,(H,16,17)
InChI Key:
RFLWKIUUHREFSC-UHFFFAOYSA-N
SMILES:
O=c1[nH]ccc2c1cc(cc2)c1ccncc1
Properties
Complexity:
320  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
222.079g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
222.247g/mol
Monoisotopic Mass:
222.079g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
42A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9  
Properties