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Home > Nitro Compounds > 100866-84-0
100866-84-0 | Benzene, 4-methyl-2-nitro-1-(phenylmethoxy)-
CAS No: 100866-84-0 Catalog No: AG00H9D2 MDL No:
Product Description
Catalog Number:
AG00H9D2
Chemical Name:
Benzene, 4-methyl-2-nitro-1-(phenylmethoxy)-
CAS Number:
100866-84-0
IUPAC Name:
4-methyl-2-nitro-1-phenylmethoxybenzene
InChI:
InChI=1S/C14H13NO3/c1-11-7-8-14(13(9-11)15(16)17)18-10-12-5-3-2-4-6-12/h2-9H,10H2,1H3
InChI Key:
SQMZODGIHXHNAW-UHFFFAOYSA-N
Properties
Complexity:
271
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
243.09g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
243.262g/mol
Monoisotopic Mass:
243.09g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
55A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6
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