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Home > Nitro Compounds > 89410-18-4
89410-18-4 | Benzene, 1-cyclopentyl-4-nitro-
CAS No: 89410-18-4 Catalog No: AG004407 MDL No:
Product Description
Catalog Number:
AG004407
Chemical Name:
Benzene, 1-cyclopentyl-4-nitro-
CAS Number:
89410-18-4
Molecular Formula:
C11H13NO2
Molecular Weight:
191.2264
IUPAC Name:
1-cyclopentyl-4-nitrobenzene
InChI:
InChI=1S/C11H13NO2/c13-12(14)11-7-5-10(6-8-11)9-3-1-2-4-9/h5-9H,1-4H2
InChI Key:
ASZGEZWODFLQLS-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1ccc(cc1)C1CCCC1
Properties
Complexity:
198
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
191.095g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
191.23g/mol
Monoisotopic Mass:
191.095g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
45.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.9
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