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Home > Other Heterocycles > 2092036-28-5
2092036-28-5 | 1-{1-oxa-4,9-diazaspiro[5.5]undecan-9-yl}butan-1-one
CAS No: 2092036-28-5 Catalog No: AG01C75T MDL No:MFCD31434243
Product Description
Catalog Number:
AG01C75T
Chemical Name:
1-{1-oxa-4,9-diazaspiro[5.5]undecan-9-yl}butan-1-one
CAS Number:
2092036-28-5
Molecular Formula:
C12H22N2O2
Molecular Weight:
226.3153
MDL Number:
MFCD31434243
IUPAC Name:
1-(1-oxa-4,9-diazaspiro[5.5]undecan-9-yl)butan-1-one
InChI:
InChI=1S/C12H22N2O2/c1-2-3-11(15)14-7-4-12(5-8-14)10-13-6-9-16-12/h13H,2-10H2,1H3
InChI Key:
SVJYUHNFJBDOJH-UHFFFAOYSA-N
SMILES:
CCCC(=O)N1CCC2(CC1)OCCNC2
Properties
Complexity:
247
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
226.168g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
226.32g/mol
Monoisotopic Mass:
226.168g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
41.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.1
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