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2,4,6-Tri-tert-butylnitrosobenzene - >98.0%(GC), high purity , CAS No.24973-59-9

COA

Grade & Purity:

≥98%

Cas Number: 24973-59-9
Molecular Weight: 275.44
MDL number: MFCD00008817
PubChem CID: 90676

In stock

Item Number

T161849

Grouped product items
SKU	Size	Availability	Price
T161849-100mg	100mg	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$66.90
T161849-250mg	250mg	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$139.90
T161849-1g	1g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$468.90

View related series

Benzene ring compounds (72) Spectroscopic reagent (233)

Basic Description

Synonyms	AS-68087 \| AKOS004120290 \| OSICDPWAPKXXHT-UHFFFAOYSA-N \| SZX3GP4GT9 \| 1,3,5-Tri-tert-butyl-2-nitrosobenzene \| 1,3,5-Tritert-butyl-2-nitrosobenzene \| 1,3,5-tritert-butyl-2-nitroso-benzene \| FT-0745688 \| 2-Nitroso-1,3,5-tri-tert-butylbenzene \| EINECS 246-55
Specifications & Purity	≥98%
Storage Temp	Store at 2-8°C,Argon charged
Shipped In	Wet ice This product requires cold chain shipping. Ground and other economy services are not available.

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Benzenoids
  - Class Benzene and substituted derivatives
    - Subclass Phenylpropanes

Kingdom	Organic compounds
Superclass	Benzenoids
Class	Benzene and substituted derivatives
Subclass	Phenylpropanes
Intermediate Tree Nodes	Not available
Direct Parent	Phenylpropanes
Alternative Parents	Propargyl-type 1,3-dipolar organic compounds C-nitroso compounds Organopnictogen compounds Organic oxides Hydrocarbon derivatives
Molecular Framework	Aromatic homomonocyclic compounds
Substituents	Phenylpropane - Organic nitroso compound - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - C-nitroso compound - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organonitrogen compound - Aromatic homomonocyclic compound
Description	This compound belongs to the class of organic compounds known as phenylpropanes. These are organic compounds containing a phenylpropane moiety.
External Descriptors	Not available
1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61. DOI: 10.1186/s13321-016-0174-y

Names and Identifiers

IUPAC Name	1,3,5-tritert-butyl-2-nitrosobenzene
INCHI	InChI=1S/C18H29NO/c1-16(2,3)12-10-13(17(4,5)6)15(19-20)14(11-12)18(7,8)9/h10-11H,1-9H3
InChIKey	OSICDPWAPKXXHT-UHFFFAOYSA-N
Smiles	CC(C)(C)C1=CC(=C(C(=C1)C(C)(C)C)N=O)C(C)(C)C
Isomeric SMILES	CC(C)(C)C1=CC(=C(C(=C1)C(C)(C)C)N=O)C(C)(C)C
PubChem CID	90676
Molecular Weight	275.44
Reaxy-Rn	1880006

Certificates（CoA,COO,BSE/TSE and Analysis Chart)

C of A & Other Certificates(BSE/TSE, COO):

Analytical Chart:

Chemical and Physical Properties

Sensitivity	Air Sensitive,Heat Sensitive
Melt Point(°C)	168°C(lit.)
Molecular Weight	275.400 g/mol
XLogP3	6.300
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	3
Exact Mass	275.225 Da
Monoisotopic Mass	275.225 Da
Topological Polar Surface Area	29.400 Å²
Heavy Atom Count	20
Formal Charge	0
Complexity	316.000
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
The total count of all stereochemical bonds	0
Covalently-Bonded Unit Count	1

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