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Home > Other Heterocycles > 79530-81-7
79530-81-7 | Piperazine,1-(1R,2S,5S)-bicyclo[3.1.0]hex-2-yl-4-methyl-, rel-
CAS No: 79530-81-7 Catalog No: AG005891 MDL No:
Product Description
Catalog Number:
AG005891
Chemical Name:
Piperazine,1-(1R,2S,5S)-bicyclo[3.1.0]hex-2-yl-4-methyl-, rel-
CAS Number:
79530-81-7
Molecular Formula:
C11H20N2
Molecular Weight:
180.2899
IUPAC Name:
1-[(1R,2S,5S)-2-bicyclo[3.1.0]hexanyl]-4-methylpiperazine
InChI:
InChI=1S/C11H20N2/c1-12-4-6-13(7-5-12)11-3-2-9-8-10(9)11/h9-11H,2-8H2,1H3/t9-,10+,11-/m0/s1
InChI Key:
QTMPYFNVVDRVAK-AXFHLTTASA-N
SMILES:
CN1CCN(CC1)[C@H]1CC[C@@H]2[C@H]1C2
Properties
Complexity:
196
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
3
Defined Bond Stereocenter Count:
0
Exact Mass:
180.163g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
180.295g/mol
Monoisotopic Mass:
180.163g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
6.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3
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