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Home > Other Heterocycles > 1820580-36-6
1820580-36-6 | rac-(1S,5R)-9-methyl-3,9-diazabicyclo[3.3.2]decane dihydrochloride
CAS No: 1820580-36-6 Catalog No: AG00J2OB MDL No:MFCD28024753
Product Description
Catalog Number:
AG00J2OB
Chemical Name:
rac-(1S,5R)-9-methyl-3,9-diazabicyclo[3.3.2]decane dihydrochloride
CAS Number:
1820580-36-6
Molecular Formula:
C9H20Cl2N2
Molecular Weight:
227.1745
MDL Number:
MFCD28024753
IUPAC Name:
(1S,5R)-9-methyl-3,9-diazabicyclo[3.3.2]decane;dihydrochloride
InChI:
InChI=1S/C9H18N2.2ClH/c1-11-7-8-3-2-4-9(11)6-10-5-8;;/h8-10H,2-7H2,1H3;2*1H/t8-,9+;;/m1../s1
InChI Key:
FPNFBQMYWMVKEG-BPRGXCPLSA-N
SMILES:
CN1C[C@@H]2CCC[C@H]1CNC2.Cl.Cl
Properties
Complexity:
136
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3
Defined Atom Stereocenter Count:
2
Defined Bond Stereocenter Count:
0
Exact Mass:
226.1g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
227.173g/mol
Monoisotopic Mass:
226.1g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
15.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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