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151213-40-0 | 1H-Pyrrolo[3,4-b]pyridine, octahydro-, (4aS,7aS)-
CAS No: 151213-40-0 Catalog No: AG001N6U MDL No:MFCD08458306
Product Description
Catalog Number:
AG001N6U
Chemical Name:
1H-Pyrrolo[3,4-b]pyridine, octahydro-, (4aS,7aS)-
CAS Number:
151213-40-0
Molecular Formula:
C7H14N2
Molecular Weight:
126.1995
MDL Number:
MFCD08458306
IUPAC Name:
(4aS,7aS)-2,3,4,4a,5,6,7,7a-octahydro-1H-pyrrolo[3,4-b]pyridine
InChI:
InChI=1S/C7H14N2/c1-2-6-4-8-5-7(6)9-3-1/h6-9H,1-5H2/t6-,7+/m0/s1
InChI Key:
KSCPLKVBWDOSAI-NKWVEPMBSA-N
SMILES:
C1CN[C@H]2[C@@H](C1)CNC2
Properties
Complexity:
103
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
2
Defined Bond Stereocenter Count:
0
Exact Mass:
126.116g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
126.203g/mol
Monoisotopic Mass:
126.116g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
24.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0
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