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Home > Nitro Compounds > 954261-97-3
954261-97-3 | 1-(2-nitrophenyl)sulfonyl-1,4-diazepane
CAS No: 954261-97-3 Catalog No: AG00IJ4C MDL No:MFCD09737813
Product Description
Catalog Number:
AG00IJ4C
Chemical Name:
1-(2-nitrophenyl)sulfonyl-1,4-diazepane
CAS Number:
954261-97-3
MDL Number:
MFCD09737813
IUPAC Name:
1-(2-nitrophenyl)sulfonyl-1,4-diazepane
InChI:
InChI=1S/C11H15N3O4S/c15-14(16)10-4-1-2-5-11(10)19(17,18)13-8-3-6-12-7-9-13/h1-2,4-5,12H,3,6-9H2
InChI Key:
VBDLQKCVPSPMID-UHFFFAOYSA-N
Properties
Complexity:
415
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
285.078g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
285.318g/mol
Monoisotopic Mass:
285.078g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
104A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.6
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