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Home > Other Heterocycles > 1408076-09-4
1408076-09-4 | 7-Oxa-2-azaspiro[3.5]nonane, ethanedioate (1:1)
CAS No: 1408076-09-4 Catalog No: AG001CUR MDL No:MFCD22422285
Product Description
Catalog Number:
AG001CUR
Chemical Name:
7-Oxa-2-azaspiro[3.5]nonane, ethanedioate (1:1)
CAS Number:
1408076-09-4
Molecular Formula:
C9H15NO5
Molecular Weight:
217.2191
MDL Number:
MFCD22422285
IUPAC Name:
7-oxa-2-azaspiro[3.5]nonane;oxalic acid
InChI:
InChI=1S/2C7H13NO.C2H2O4/c2*1-3-9-4-2-7(1)5-8-6-7;3-1(4)2(5)6/h2*8H,1-6H2;(H,3,4)(H,5,6)
InChI Key:
DWJWLMVIJBWYFP-UHFFFAOYSA-N
SMILES:
O1CCC2(CC1)CNC2.OC(=O)C(=O)O
Properties
Complexity:
173
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
344.195g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
8
Hydrogen Bond Donor Count:
4
Isotope Atom Count:
0
Molecular Weight:
344.408g/mol
Monoisotopic Mass:
344.195g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
117A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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