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Home > Nitro Compounds > 138272-17-0
138272-17-0 | Benzene, 1-dodecyl-2,3,5,6-tetramethyl-4-nitroso-
CAS No: 138272-17-0 Catalog No: AG0018FP MDL No:
Product Description
Catalog Number:
AG0018FP
Chemical Name:
Benzene, 1-dodecyl-2,3,5,6-tetramethyl-4-nitroso-
CAS Number:
138272-17-0
Molecular Formula:
C22H37NO
Molecular Weight:
331.5353
IUPAC Name:
1-dodecyl-2,3,5,6-tetramethyl-4-nitrosobenzene
InChI:
InChI=1S/C22H37NO/c1-6-7-8-9-10-11-12-13-14-15-16-21-17(2)19(4)22(23-24)20(5)18(21)3/h6-16H2,1-5H3
InChI Key:
AJAGVMUUIBVVPX-UHFFFAOYSA-N
SMILES:
CCCCCCCCCCCCc1c(C)c(C)c(c(c1C)C)N=O
Properties
Complexity:
314
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
331.288g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
331.544g/mol
Monoisotopic Mass:
331.288g/mol
Rotatable Bond Count:
11
Topological Polar Surface Area:
29.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
9
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