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Home > Nitro Compounds > 524034-47-7
524034-47-7 | 4-(3-nitro-4-piperazin-1-ylbenzoyl)morpholine
CAS No: 524034-47-7 Catalog No: AG00JH9Y MDL No:MFCD03306507
Product Description
Catalog Number:
AG00JH9Y
Chemical Name:
4-(3-nitro-4-piperazin-1-ylbenzoyl)morpholine
CAS Number:
524034-47-7
Molecular Formula:
C15H20N4O4
Molecular Weight:
320.3437
MDL Number:
MFCD03306507
IUPAC Name:
morpholin-4-yl-(3-nitro-4-piperazin-1-ylphenyl)methanone
InChI:
InChI=1S/C15H20N4O4/c20-15(18-7-9-23-10-8-18)12-1-2-13(14(11-12)19(21)22)17-5-3-16-4-6-17/h1-2,11,16H,3-10H2
InChI Key:
PLQKRKODRQRDGR-UHFFFAOYSA-N
SMILES:
O=C(c1ccc(c(c1)[N+](=O)[O-])N1CCNCC1)N1CCOCC1
Properties
Complexity:
430
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
320.148g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
320.349g/mol
Monoisotopic Mass:
320.148g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
90.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.3
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