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Home > Nitro Compounds > 68052-13-1
68052-13-1 | 1-(2,5-diethoxy-4-nitrophenyl)pyrrolidine
CAS No: 68052-13-1 Catalog No: AG00FOG9 MDL No:
Product Description
Catalog Number:
AG00FOG9
Chemical Name:
1-(2,5-diethoxy-4-nitrophenyl)pyrrolidine
CAS Number:
68052-13-1
IUPAC Name:
1-(2,5-diethoxy-4-nitrophenyl)pyrrolidine
InChI:
InChI=1S/C14H20N2O4/c1-3-19-13-10-12(16(17)18)14(20-4-2)9-11(13)15-7-5-6-8-15/h9-10H,3-8H2,1-2H3
InChI Key:
KBGMGRHASIXYHM-UHFFFAOYSA-N
EC Number:
268-306-9
Properties
Complexity:
315
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
280.142g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
280.324g/mol
Monoisotopic Mass:
280.142g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
67.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3
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