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135-15-9 | 2,5-DI-N-BUTOXYNITROBENZENE
CAS No: 135-15-9 Catalog No: AG003G09 MDL No:
Product Description
Catalog Number:
AG003G09
Chemical Name:
2,5-DI-N-BUTOXYNITROBENZENE
CAS Number:
135-15-9
IUPAC Name:
1,4-dibutoxy-2-nitrobenzene
InChI:
InChI=1S/C14H21NO4/c1-3-5-9-18-12-7-8-14(19-10-6-4-2)13(11-12)15(16)17/h7-8,11H,3-6,9-10H2,1-2H3
InChI Key:
UVLGMZCLSQBSPZ-UHFFFAOYSA-N
EC Number:
205-180-6
NSC Number:
133444
Properties
Complexity:
254
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
267.147g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
267.325g/mol
Monoisotopic Mass:
267.147g/mol
Rotatable Bond Count:
8
Topological Polar Surface Area:
64.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.6
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