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Home > Other Heterocycles > 1408075-68-2
1408075-68-2 | 8-Oxa-2-azaspiro[4.5]decane, ethanedioate (1:1)
CAS No: 1408075-68-2 Catalog No: AG001CTU MDL No:MFCD23106140
Product Description
Catalog Number:
AG001CTU
Chemical Name:
8-Oxa-2-azaspiro[4.5]decane, ethanedioate (1:1)
CAS Number:
1408075-68-2
Molecular Formula:
C10H17NO5
Molecular Weight:
231.2457
MDL Number:
MFCD23106140
IUPAC Name:
8-oxa-2-azaspiro[4.5]decane;oxalic acid
InChI:
InChI=1S/C8H15NO.C2H2O4/c1-4-9-7-8(1)2-5-10-6-3-8;3-1(4)2(5)6/h9H,1-7H2;(H,3,4)(H,5,6)
InChI Key:
BEEYWXWKBOFYSE-UHFFFAOYSA-N
SMILES:
O1CCC2(CC1)CNCC2.OC(=O)C(=O)O
Properties
Complexity:
190
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
231.111g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
231.248g/mol
Monoisotopic Mass:
231.111g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
95.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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