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Home > Other Heterocycles > 1365639-13-9
1365639-13-9 | 2-Azaspiro[3.3]heptane, ethanedioate (2:1)
CAS No: 1365639-13-9 Catalog No: AG001224 MDL No:MFCD21642066
Product Description
Catalog Number:
AG001224
Chemical Name:
2-Azaspiro[3.3]heptane, ethanedioate (2:1)
CAS Number:
1365639-13-9
Molecular Formula:
C14H24N2O4
Molecular Weight:
284.3514
MDL Number:
MFCD21642066
IUPAC Name:
2-azaspiro[3.3]heptane;oxalic acid
InChI:
InChI=1S/2C6H11N.C2H2O4/c2*1-2-6(3-1)4-7-5-6;3-1(4)2(5)6/h2*7H,1-5H2;(H,3,4)(H,5,6)
InChI Key:
BNWFMJVKAIJDRK-UHFFFAOYSA-N
SMILES:
C1CC2(C1)CNC2.C1CC2(C1)CNC2.OC(=O)C(=O)O
Properties
Complexity:
150
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
284.174g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
4
Isotope Atom Count:
0
Molecular Weight:
284.356g/mol
Monoisotopic Mass:
284.174g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
98.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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