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Home > Nitro Compounds > 70227-29-1
70227-29-1 | 3-nitrophencyclidine
CAS No: 70227-29-1 Catalog No: AG00FTZN MDL No:
Product Description
Catalog Number:
AG00FTZN
Chemical Name:
3-nitrophencyclidine
CAS Number:
70227-29-1
IUPAC Name:
1-[1-(3-nitrophenyl)cyclohexyl]piperidine
InChI:
InChI=1S/C17H24N2O2/c20-19(21)16-9-7-8-15(14-16)17(10-3-1-4-11-17)18-12-5-2-6-13-18/h7-9,14H,1-6,10-13H2
InChI Key:
FNBJJYLGOXMMHZ-UHFFFAOYSA-N
Properties
Complexity:
354
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
288.184g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
288.391g/mol
Monoisotopic Mass:
288.184g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
49.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5
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