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Home > Other Heterocycles > 119999-79-0
119999-79-0 | 1-Oxa-7,8-diazaspiro[4.4]nonane (9CI)
CAS No: 119999-79-0 Catalog No: AG000PZW MDL No:
Product Description
Catalog Number:
AG000PZW
Chemical Name:
1-Oxa-7,8-diazaspiro[4.4]nonane (9CI)
CAS Number:
119999-79-0
Molecular Formula:
C6H12N2O
Molecular Weight:
128.1723
IUPAC Name:
6-oxa-2,3-diazaspiro[4.4]nonane
InChI:
InChI=1S/C6H12N2O/c1-2-6(9-3-1)4-7-8-5-6/h7-8H,1-5H2
InChI Key:
IUBVEUZKEZXPGB-UHFFFAOYSA-N
SMILES:
C1COC2(C1)CNNC2
Properties
Complexity:
110
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
128.095g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
128.175g/mol
Monoisotopic Mass:
128.095g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
33.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.4
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