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Home > Nitro Compounds > 91645-08-8
91645-08-8 | 4-tert-butyl-1-ethoxy-2-nitrobenzene
CAS No: 91645-08-8 Catalog No: AG00IGTE MDL No:
Product Description
Catalog Number:
AG00IGTE
Chemical Name:
4-tert-butyl-1-ethoxy-2-nitrobenzene
CAS Number:
91645-08-8
IUPAC Name:
4-tert-butyl-1-ethoxy-2-nitrobenzene
InChI:
InChI=1S/C12H17NO3/c1-5-16-11-7-6-9(12(2,3)4)8-10(11)13(14)15/h6-8H,5H2,1-4H3
InChI Key:
OGHAVVWZKPGLIM-UHFFFAOYSA-N
Properties
Complexity:
242
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
223.121g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
223.272g/mol
Monoisotopic Mass:
223.121g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
55A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.8
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