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Home > Nitro Compounds > 95857-32-2
95857-32-2 | Benzene, 1-nitro-4-pentyl-
CAS No: 95857-32-2 Catalog No: AG00IJHF MDL No:
Product Description
Catalog Number:
AG00IJHF
Chemical Name:
Benzene, 1-nitro-4-pentyl-
CAS Number:
95857-32-2
IUPAC Name:
1-nitro-4-pentylbenzene
InChI:
InChI=1S/C11H15NO2/c1-2-3-4-5-10-6-8-11(9-7-10)12(13)14/h6-9H,2-5H2,1H3
InChI Key:
ZHXFSPASCJVKKA-UHFFFAOYSA-N
Properties
Complexity:
169
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
193.11g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
193.246g/mol
Monoisotopic Mass:
193.11g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
45.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.9
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