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Home > Other Heterocycles > 1523571-99-4
1523571-99-4 | 6-Oxa-1-azaspiro[3.4]octane hemioxalate
CAS No: 1523571-99-4 Catalog No: AG00HY09 MDL No:MFCD27988009
Product Description
Catalog Number:
AG00HY09
Chemical Name:
6-Oxa-1-azaspiro[3.4]octane hemioxalate
CAS Number:
1523571-99-4
Molecular Formula:
C14H24N2O6
Molecular Weight:
316.3502
MDL Number:
MFCD27988009
IUPAC Name:
7-oxa-1-azaspiro[3.4]octane;oxalic acid
InChI:
InChI=1S/2C6H11NO.C2H2O4/c2*1-3-7-6(1)2-4-8-5-6;3-1(4)2(5)6/h2*7H,1-5H2;(H,3,4)(H,5,6)
InChI Key:
UYHNJOQRRFVIHM-UHFFFAOYSA-N
SMILES:
O1CCC2(C1)CCN2.O1CCC2(C1)CCN2.OC(=O)C(=O)O
Properties
Complexity:
176
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
316.163g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
8
Hydrogen Bond Donor Count:
4
Isotope Atom Count:
0
Molecular Weight:
316.354g/mol
Monoisotopic Mass:
316.163g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
117A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
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