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Home > Other Heterocycles > 2138180-89-7
2138180-89-7 | 4-benzyl-2-methyl-1-oxa-4,9-diazaspiro[5.5]undecane dihydrochloride
CAS No: 2138180-89-7 Catalog No: AG01EJ9K MDL No:MFCD31457206
Product Description
Catalog Number:
AG01EJ9K
Chemical Name:
4-benzyl-2-methyl-1-oxa-4,9-diazaspiro[5.5]undecane dihydrochloride
CAS Number:
2138180-89-7
Molecular Formula:
C16H26Cl2N2O
Molecular Weight:
333.2964
MDL Number:
MFCD31457206
IUPAC Name:
4-benzyl-2-methyl-1-oxa-4,9-diazaspiro[5.5]undecane;dihydrochloride
InChI:
InChI=1S/C16H24N2O.2ClH/c1-14-11-18(12-15-5-3-2-4-6-15)13-16(19-14)7-9-17-10-8-16;;/h2-6,14,17H,7-13H2,1H3;2*1H
InChI Key:
SSCJBCMANANQTB-UHFFFAOYSA-N
SMILES:
CC1CN(Cc2ccccc2)CC2(O1)CCNCC2.Cl.Cl
Properties
Complexity:
283
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
332.142g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
333.297g/mol
Monoisotopic Mass:
332.142g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
24.5A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
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