3,5-ビス(1,1-ジメチルエチル)-4-ヒドロキシベンゼンプロピオン酸ヒドラジド

3,5-Di-tert-butyl-4-hydroxyhydrocinnamic acid hydrazide

HCID 64865CAS 32687-77-7

部分構造検索類似構造を探す

基本情報

標準SMILES: CC(C)(C)c1cc(CCC(=O)NN)cc(C(C)(C)C)c1O
InChIKey: KMWIPXLIKIAZMT-UHFFFAOYSA-N
分子式: C17H28N2O2
平均分子量: 292.4 g/mol
単同位体質量: 292.21507814

名称と識別子

優先名称: 3,5-Di-tert-butyl-4-hydroxyhydrocinnamic acid hydrazide
IUPAC: 3-(3,5-ditert-butyl-4-hydroxyphenyl)propanehydrazide
現地名: 3,5-ビス(1,1-ジメチルエチル)-4-ヒドロキシベンゼンプロピオン酸ヒドラジド
英語名: 3-(3,5-Di-tert-butyl-4-hydroxyphenyl)propanohydrazide
分子式: C17H28N2O2
分子量: 292.42

名称と別名

3,5-Di-tert-butyl-4-hydroxyhydrocinnamic acid hydrazide3-[3,5-di(tert-butyl)-4-hydroxyphenyl]propanohydrazideLuchem aor 300EINECS 251-155-896J1F05K583-(3,5-Di-tert-butyl-4-hydroxyphenyl)propionohydrazideBenzenepropanoic acid, 3,5-bis(1,1-dimethylethyl)-4-hydroxy-, hydrazide3,5-Di-tert-butyl-4-hydroxyhydrocinnamic acid, hydrazide3-(3,5-Di-tert-butyl-4-hydroxyphenyl)propionic acid hydrazideHydrocinnamic acid, 3,5-di-tert-butyl-4-hydroxy-, hydrazide3-(3,5-DI(TERT-BUTYL)-4-HYDROXYPHENYL)PROPANOHYDRAZIDE3-(3,5-DI-TERT-BUTYL-4-HYDROXYPHENYL)PROPIONYLHYDRAZINE

名称をさらに表示

3,5-ビス(1,1-ジメチルエチル)-4-ヒドロキシベンゼンプロピオン酸ヒドラジド3-[3,5-ジ(tert-ブチル)-4-ヒドロキシフェニル]プロパノヒドラジン3-(3,5-ditert-butyl-4-hydroxyphenyl)propanehydrazide3-(3,5-ditert-butyl-4-hydroxy-phenyl)propanehydrazide3-(3,5-Ditertbutyl-4-hydroxyphenyl)propionyl hydrazineb-(3,5-Di-tert-butyl-4-hydroxyphenyl)propionic acid hydrazide3,5-Bis(1,1-dimethylethyl)-4-hydroxybenzenepropionic acid hydrazideBENZENEPROPANOICACID,3,5-BIS(1,1-DIMETHYLETHYL)-4-HYDROXY-,HYDRAZIDE3-(3,5-DI-TERT-BUTYL-4-HYDROXYPHENYL)PROPIONYL HYDRAZINE, 98.0%MIN (HPLC)

.BETA.-(3,5-DI-TERT-BUTYL-4-HYDROXYPHENYL)PROPIONYL HYDRAZIDE3,5-bis(1,1-dimethylethyl)-4-hydroxybenzenepropanoic acid hydrazideN-(.BETA.-(3,5-DI-TERT-BUTYL-4-HYDROXYPHENYL)PROPIONYL)HYDRAZINERefChem:486584BETA-(3,5-DI-TERT-BUTYL-4-HYDROXYPHENYL)PROPIONYL HYDRAZIDEN-(BETA-(3,5-DI-TERT-BUTYL-4-HYDROXYPHENYL)PROPIONYL)HYDRAZINE32687-77-73-(3,5-di-tert-butyl-4-hydroxyphenyl)propanehydrazide

データベース識別子

CAS: 32687-77-7
PubChem CID: 64865
DTXSID: DTXSID1027978
ChEMBL: CHEMBL1586239
UNII: 96J1F05K58
EC Number: 251-155-8
Nikkaji: J319.417E

物性

構造計算による物性

XLogP: 3.7
極性表面積: 75.4 Å²
水素結合供与体数: 3
水素結合受容体数: 3
回転可能結合数: 5
重原子数: 21
形式電荷: 0
複雑度: 331

実験および物理化学的性質

Solubility26.6 [ug/mL] (The mean of the results at pH 7.4)

Collision Cross Section174.5 Å² [M-H]- [CCS Type: DT; Buffer gas: N2; Ionization: ESI-; Dataset: TOXCAST; Source Identifier: DTXSID1027978]

物理化学的性質

融点: 147 · 147-150°C
EPAの化学物質情報: 3 · 3,5-Di-tert-butyl-4-hydroxyhydrocinnamic acid hydrazide (32687-77-7)

安全と法規制

GHS分類

GHS Classification · 3 件

This chemical does not meet GHS hazard criteria for 99% (104 of 105) of all reports.

Not Classified

Aggregated GHS information provided per 105 reports by companies from 2 notifications to the ECHA C&L Inventory.

危険有害性情報

Hazard Classes and CategoriesNot Classified

安全データ

tsca: TSCA listed
risk_code: 25
hazard_code: T
safety_code: 45
hazard_class: IRRITANT

化学と産業

用途と製造

General Manufacturing InformationBenzenepropanoic acid, 3,5-bis(1,1-dimethylethyl)-4-hydroxy-, hydrazide: ACTIVE

上流・下流製品情報

下流製品

酸化防止1024

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