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Home > Other Heterocycles > 1638221-35-8
1638221-35-8 | 1,4,9-triazaspiro[5.5]undecan-5-one dihydrochloride
CAS No: 1638221-35-8 Catalog No: AG00J395 MDL No:MFCD28122926
Product Description
Catalog Number:
AG00J395
Chemical Name:
1,4,9-triazaspiro[5.5]undecan-5-one dihydrochloride
CAS Number:
1638221-35-8
Molecular Formula:
C8H17Cl2N3O
Molecular Weight:
242.1461
MDL Number:
MFCD28122926
IUPAC Name:
1,4,9-triazaspiro[5.5]undecan-5-one;dihydrochloride
InChI:
InChI=1S/C8H15N3O.2ClH/c12-7-8(11-6-5-10-7)1-3-9-4-2-8;;/h9,11H,1-6H2,(H,10,12);2*1H
InChI Key:
OXFSLLMEPPTYDY-UHFFFAOYSA-N
SMILES:
O=C1NCCNC21CCNCC2.Cl.Cl
Properties
Complexity:
187
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
241.075g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
5
Isotope Atom Count:
0
Molecular Weight:
242.144g/mol
Monoisotopic Mass:
241.075g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
53.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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