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Home > Other Heterocycles > 707-45-9
707-45-9 | SPIRO[3.3]HEPTANE-2,6-DICARBOXAMIDE
CAS No: 707-45-9 Catalog No: AG005GNE MDL No:
Product Description
Catalog Number:
AG005GNE
Chemical Name:
SPIRO[3.3]HEPTANE-2,6-DICARBOXAMIDE
CAS Number:
707-45-9
Molecular Formula:
C9H14N2O2
Molecular Weight:
182.2197
IUPAC Name:
spiro[3.3]heptane-2,6-dicarboxamide
InChI:
InChI=1S/C9H14N2O2/c10-7(12)5-1-9(2-5)3-6(4-9)8(11)13/h5-6H,1-4H2,(H2,10,12)(H2,11,13)
InChI Key:
ACKODFNIGGGCBA-UHFFFAOYSA-N
SMILES:
NC(=O)C1CC2(C1)CC(C2)C(=O)N
UNII:
6ORN04TZ9D
NSC Number:
47620
Properties
Complexity:
231
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
182.106g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
182.223g/mol
Monoisotopic Mass:
182.106g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
86.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.9
Literature
| Title | Journal |
|---|---|
| Microsphere-based protease assays and screening application for lethal factor and factor Xa. | Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501 |
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