CAS 70693-50-4 2,4-Bis(1-methyl-1-phenylethyl)-6-[2-(2-nitrophenyl)diazenyl]phenol (HCID 116810)

基本情報

CAS: 70693-50-4
標準SMILES: CC(C)(c1ccccc1)c1cc(N=Nc2ccccc2[N+](=O)[O-])c(O)c(C(C)(C)c2ccccc2)c1
InChIKey: CZEIGGLJGJHNCD-UHFFFAOYSA-N
分子式: C30H29N3O3
平均分子量: 479.6 g/mol
単同位体質量: 479.22089179

名称と識別子

優先名称: 2,4-Bis(1-methyl-1-phenylethyl)-6-[2-(2-nitrophenyl)diazenyl]phenol
IUPAC: 2-[(2-nitrophenyl)diazenyl]-4,6-bis(2-phenylpropan-2-yl)phenol
現地名: 2,4-ビス(1-メチル-1-フェニルエチル)-6-[(2-ニトロフェニル)アゾ]フェノール
英語名: 2,4-bis(1-methyl-1-phenylethyl)-6-[(2-nitrophenyl)azo]phenol
分子式: C30H29N3O3
分子量: 479.57

名称と別名

70693-50-42,4-Bis(1-methyl-1-phenylethyl)-6-(2-(2-nitrophenyl)diazenyl)phenol2,4-Bis(1-methyl-1-phenylethyl)-6-[2-(2-nitrophenyl)diazenyl]phenolRefChem:1973642,4-Bis(1-methyl-1-phenylethyl)-6-((2-nitrophenyl)azo)phenolL27V2914MRPhenol, 2,4-bis(1-methyl-1-phenylethyl)-6-((2-nitrophenyl)azo)-Phenol, 2,4-bis(1-methyl-1-phenylethyl)-6-(2-(2-nitrophenyl)diazenyl)-EINECS 274-768-2UNII-L27V2914MR2-((2-Nitrophenyl)diazenyl)-4,6-bis(2-phenylpropan-2-yl)phenol2-[(2-Nitrophenyl)diazenyl]-4,6-bis(2-phenylpropan-2-yl)phenol

名称をさらに表示

2,4-ビス(1-メチル-1-フェニルエチル)-6-[(2-ニトロフェニル)アゾ]フェノール2-[2-(2-ニトロフェニル)ジアゼン-1-イル]-4,6-ビス(2-フェニルプロパン-2-イル)フェノール2,4-bis(1-methyl-1-phenylethyl)-6-[(2-nitrophenyl)azo]phenol

Phenol, 2,4-bis(1-methyl-1-phenylethyl)-6-[2-(2-nitrophenyl)diazenyl]-2-Nitro-2'-hydroxy-3',5'-bis(alpha,alpha-dimethylbenzyl)azobenzeneSCHEMBL6860824SCHEMBL6860828DTXSID1028994SCHEMBL30553824NS00062634Q27282611

物性

構造計算による物性

XLogP: 8.8
極性表面積: 90.8 Å²
水素結合供与体数: 1
水素結合受容体数: 5
回転可能結合数: 6
重原子数: 36
形式電荷: 0
複雑度: 749

実験および物理化学的性質

Endocrine DisruptorsPotential endocrine disrupting compound

Physical DescriptionOther Solid

物理化学的性質

EPAの化学物質情報: 2 · Phenol, 2,4-bis(1-methyl-1-phenylethyl)-6-[2-(2-nitrophenyl)diazenyl]- (70693-50-4)

安全と法規制

危険有害性情報

Regulatory Information · 1 件

Phenol, 2,4-bis(1-methyl-1-phenylethyl)-6-[2-(2-nitrophenyl)diazenyl]- is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of Phenol, 2,4-bis(1-methyl-1-phenylethyl)-6-[2-(2-nitrophenyl)diazenyl]- are required to report information about their production and use of this chemical to the EPA under the Toxic Substances Control Act (TSCA). (40 eCFR Part 711)

安全データ

tsca: TSCA listed

化学と産業

用途と製造

U.S. Production2023: 550,000 - <1,000,000 lb

Industry UsesIntermediate

General Manufacturing Information · 2 件

All Other Basic Organic Chemical Manufacturing

Phenol, 2,4-bis(1-methyl-1-phenylethyl)-6-[2-(2-nitrophenyl)diazenyl]-: ACTIVE

応用分野

使用2-((2-Nitrophenyl)diazenyl)-4,6-bis(2-phenylpropan-2-yl)phenol is an intermediate in the synthesis of Benzotriazole BT (B206990), a low volatile benzotriazole UV light absorber and stabilizer.