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1171506-89-0

1171506-89-0 | 3,9-Diazaspiro[5.5]undecane, 3-(phenylmethyl)-, hydrochloride (1:2)

CAS No: 1171506-89-0 Catalog No: AG000DTD MDL No:MFCD09910203

Product Description

Catalog Number:
AG000DTD
Chemical Name:
3,9-Diazaspiro[5.5]undecane, 3-(phenylmethyl)-, hydrochloride (1:2)
CAS Number:
1171506-89-0
Molecular Formula:
C16H26Cl2N2
Molecular Weight:
317.2970
MDL Number:
MFCD09910203
IUPAC Name:
3-benzyl-3,9-diazaspiro[5.5]undecane;dihydrochloride
InChI:
InChI=1S/C16H24N2.2ClH/c1-2-4-15(5-3-1)14-18-12-8-16(9-13-18)6-10-17-11-7-16;;/h1-5,17H,6-14H2;2*1H
InChI Key:
IEBAIHNMIWKNKB-UHFFFAOYSA-N
SMILES:
N1CCC2(CC1)CCN(CC2)Cc1ccccc1.Cl.Cl

Properties

Complexity:
242  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
316.147g/mol
Formal Charge:
0
Heavy Atom Count:
20  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
317.298g/mol
Monoisotopic Mass:
316.147g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
15.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0

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