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Home > Other Heterocycles > 5169-59-5
5169-59-5 | Bicyclo[2.2.1]heptan-2-one, 3-diazo-
CAS No: 5169-59-5 Catalog No: AG006U5A MDL No:
Product Description
Catalog Number:
AG006U5A
Chemical Name:
Bicyclo[2.2.1]heptan-2-one, 3-diazo-
CAS Number:
5169-59-5
Molecular Formula:
C7H8N2O
Molecular Weight:
136.1512
IUPAC Name:
3-diazobicyclo[2.2.1]heptan-2-one
InChI:
InChI=1S/C7H8N2O/c8-9-6-4-1-2-5(3-4)7(6)10/h4-5H,1-3H2
InChI Key:
VZNQVJHHUKEMOD-UHFFFAOYSA-N
SMILES:
[N-]=[N+]=C1C2CCC(C1=O)C2
Properties
Complexity:
240
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
136.064g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
136.154g/mol
Monoisotopic Mass:
136.064g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
19.1A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
1
XLogP3:
0.5
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