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Home > Nitro Compounds > 657405-94-2
657405-94-2 | 1-(7-Nitro-1,1,3,3,6-pentamethylindan-5-yl)-1H-pyrrole
CAS No: 657405-94-2 Catalog No: AG01FGGJ MDL No:
Product Description
Catalog Number:
AG01FGGJ
Chemical Name:
1-(7-Nitro-1,1,3,3,6-pentamethylindan-5-yl)-1H-pyrrole
CAS Number:
657405-94-2
IUPAC Name:
1-(1,1,3,3,6-pentamethyl-7-nitro-2H-inden-5-yl)pyrrole
InChI:
InChI=1S/C18H22N2O2/c1-12-14(19-8-6-7-9-19)10-13-15(16(12)20(21)22)18(4,5)11-17(13,2)3/h6-10H,11H2,1-5H3
InChI Key:
QBTFBQFAURJLIF-UHFFFAOYSA-N
Properties
Complexity:
449
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
298.168g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
298.386g/mol
Monoisotopic Mass:
298.168g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
50.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.1
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