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Home > Nitro Compounds > 275795-16-9
275795-16-9 | 1,1'-Biphenyl, 3-(1,1-dimethylethyl)-4-nitroso-
CAS No: 275795-16-9 Catalog No: AG002U3Z MDL No:
Product Description
Catalog Number:
AG002U3Z
Chemical Name:
1,1'-Biphenyl, 3-(1,1-dimethylethyl)-4-nitroso-
CAS Number:
275795-16-9
Molecular Formula:
C16H17NO
Molecular Weight:
239.3123
IUPAC Name:
2-tert-butyl-1-nitroso-4-phenylbenzene
InChI:
InChI=1S/C16H17NO/c1-16(2,3)14-11-13(9-10-15(14)17-18)12-7-5-4-6-8-12/h4-11H,1-3H3
InChI Key:
VJANPCXLBDGFCT-UHFFFAOYSA-N
SMILES:
O=Nc1ccc(cc1C(C)(C)C)c1ccccc1
Properties
Complexity:
275
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
239.131g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
239.318g/mol
Monoisotopic Mass:
239.131g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
29.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.6
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