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1312693-69-8

1312693-69-8 | 3H-Pyrrolo[3,4-c]pyridin-3-one, 4,6-dichloro-7-fluoro-1,2-dihydro-

CAS No: 1312693-69-8 Catalog No: AG000VTA MDL No:MFCD20486199

Product Description

Catalog Number:
AG000VTA
Chemical Name:
3H-Pyrrolo[3,4-c]pyridin-3-one, 4,6-dichloro-7-fluoro-1,2-dihydro-
CAS Number:
1312693-69-8
Molecular Formula:
C7H3Cl2FN2O
Molecular Weight:
221.0159
MDL Number:
MFCD20486199
IUPAC Name:
4,6-dichloro-7-fluoro-1,2-dihydropyrrolo[3,4-c]pyridin-3-one
InChI:
InChI=1S/C7H3Cl2FN2O/c8-5-3-2(1-11-7(3)13)4(10)6(9)12-5/h1H2,(H,11,13)
InChI Key:
XDMWQSCKMZHECI-UHFFFAOYSA-N
SMILES:
O=C1NCc2c1c(Cl)nc(c2F)Cl

Properties

Complexity:
241  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
219.961g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
221.012g/mol
Monoisotopic Mass:
219.961g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
42A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7  

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