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Home > Nitro Compounds > 416885-10-4
416885-10-4 | 1-(5-NITROPYRIDIN-2-YL)AZEPANE
CAS No: 416885-10-4 Catalog No: AG00I84Q MDL No:
Product Description
Catalog Number:
AG00I84Q
Chemical Name:
1-(5-NITROPYRIDIN-2-YL)AZEPANE
CAS Number:
416885-10-4
IUPAC Name:
1-(5-nitropyridin-2-yl)azepane
InChI:
InChI=1S/C11H15N3O2/c15-14(16)10-5-6-11(12-9-10)13-7-3-1-2-4-8-13/h5-6,9H,1-4,7-8H2
InChI Key:
CWRQTUKXBRCCOS-UHFFFAOYSA-N
Properties
Complexity:
234
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
221.116g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
221.26g/mol
Monoisotopic Mass:
221.116g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
62A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
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