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1536332-66-7

1536332-66-7 | octahydro-1H-pyrrolo[3,4-b]pyridin-2-one

CAS No: 1536332-66-7 Catalog No: AG01DVKB MDL No:MFCD24526545

Product Description

Catalog Number:
AG01DVKB
Chemical Name:
octahydro-1H-pyrrolo[3,4-b]pyridin-2-one
CAS Number:
1536332-66-7
Molecular Formula:
C7H12N2O
Molecular Weight:
140.1830
MDL Number:
MFCD24526545
IUPAC Name:
1,3,4,4a,5,6,7,7a-octahydropyrrolo[3,4-b]pyridin-2-one
InChI:
InChI=1S/C7H12N2O/c10-7-2-1-5-3-8-4-6(5)9-7/h5-6,8H,1-4H2,(H,9,10)
InChI Key:
WFNAZNCBYOHJHY-UHFFFAOYSA-N
SMILES:
O=C1CCC2C(N1)CNC2

Properties

Complexity:
158  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
140.095g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
140.186g/mol
Monoisotopic Mass:
140.095g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
41.1A^2
Undefined Atom Stereocenter Count:
2  
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.7  

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