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Home > Nitro Compounds > 1881293-94-2
1881293-94-2 | 1-butoxy-3-methyl-5-nitrobenzene
CAS No: 1881293-94-2 Catalog No: AG00I27O MDL No:
Product Description
Catalog Number:
AG00I27O
Chemical Name:
1-butoxy-3-methyl-5-nitrobenzene
CAS Number:
1881293-94-2
IUPAC Name:
1-butoxy-3-methyl-5-nitrobenzene
InChI:
InChI=1S/C11H15NO3/c1-3-4-5-15-11-7-9(2)6-10(8-11)12(13)14/h6-8H,3-5H2,1-2H3
InChI Key:
IQSPTSVNBSLVND-UHFFFAOYSA-N
Properties
Complexity:
203
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
209.105g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
209.245g/mol
Monoisotopic Mass:
209.105g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
55A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3
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