CAS 43100-38-5 Benzoic acid, 4-(1,1-dimethylethyl)-, hydrazide (HCID 123513)

名称と識別子

優先名称: Benzoic acid, 4-(1,1-dimethylethyl)-, hydrazide
IUPAC: 4-tert-butylbenzohydrazide
現地名: 4-tert-ブチルベンゾヒドラジド
英語名: 4-tert-Butylbenzhydrazide
分子式: C11H16N2O
分子量: 192.26

名称と別名

43100-38-54-tert-ButylbenzohydrazideBenzoic acid, 4-(1,1-dimethylethyl)-, hydrazidep-tert-ButylbenzohydrazideEINECS 256-090-9DTXSID7074747RefChem:565863DTXCID3040229256-090-94-tert-Butylbenzhydrazide4-(tert-Butyl)benzohydrazide4-tert-Butylbenzoic hydrazide

名称をさらに表示

4-tert-ブチルベンゾヒドラジド4-(1,1-ジメチルエチル)ベンズヒドラジド4-tert-ブチルベンズヒドラジドp-(tert-ブチル)ベンズヒドラジド4tブチルベンズヒドラジド４ｔｅｒｔブチルベンゾヒドラジド4-tert-ブチルベンズヒドラジド, 98%4-tert-ブチル安息香酸ヒドラジド4-TERT-BUTYLBEAKOS BBS-00004509BUTTPARK 44\03-79Butylbenzhydrazide4-tert-ButylbenzhydrLABOTEST-BB LT00454438

4-tert-butylbenzhyrazide4-tert-Butylbenzoic acid hydrazideMFCD000147634-(tert-butyl)benzenecarbohydrazide4-t-Butylbenzhydrazide4-t-butyl-benzhydrazideMaybridge1_008514p-(t-butyl)-benzhydrazide

データベース識別子

CAS: 43100-38-5
PubChem CID: 123513
DTXSID: DTXSID7074747
UNII: BE762NHT78
EC Number: 256-090-9
Nikkaji: J30.697E

物性

構造計算による物性

XLogP: 2
極性表面積: 55.1 Å²
水素結合供与体数: 2
水素結合受容体数: 2
回転可能結合数: 2
重原子数: 14
形式電荷: 0
複雑度: 200

実験および物理化学的性質

Physical DescriptionDry Powder

物理化学的性質

融点: 120 · 120-127 °C(lit.)
比重(密度): 1.046 · 1.046±0.06 g/cm3(Predicted)
貯蔵温度: -20 °C · Keep in dark place,Inert atmosphere,Store in freezer, under -20°C
溶解性: soluble in Methanol
外見: powder to crystal
酸解離定数(Pka): 12.82 · 12.82±0.10(Predicted)
色: White to Almost white
BRN: 1104663 · 1104663
InChI: InChI=1S/C11H16N2O/c1-11(2,3)9-6-4-8(5-7-9)10(14)13-12/h4-7H,12H2,1-3H3,(H,13,14)
InChIKey: XYUFQWDLRLHUPB-UHFFFAOYSA-N
SMILES: C(NN)(=O)C1=CC=C(C(C)(C)C)C=C1
CAS データベース: 43100 · 43100-38-5(CAS DataBase Reference)
NISTの化学物質情報: 4 · 4-Tert-butylbenzoic acid hydrazide(43100-38-5)
EPAの化学物質情報: 4 · Benzoic acid, 4-(1,1-dimethylethyl)-, hydrazide (43100-38-5)

化学的性質

化学的特性white to light beige crystalline powder or

安全と法規制

GHS分類

GHS Classification · 4 件

Warning

H302 (88.6%): Harmful if swallowed [Warning Acute toxicity, oral]

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 44 reports by companies from 4 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

危険有害性情報

Regulatory Information · 2 件

Benzoic acid, 4-(1,1-dimethylethyl)-, hydrazide is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of Benzoic acid, 4-(1,1-dimethylethyl)-, hydrazide 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)

PMN - indicates a commenced PMN (Pre-Manufacture Notices) substance.

Hazard Classes and CategoriesAcute Tox. 4 (88.6%)

安全データ

wgk: 3
tsca: TSCA listed
hs_code: 29280000
risk_code: 36/37/38-20/21/22
化審法: (3)-4326
hazard_code: Xi,Xn
safety_code: 24/25-36/37-26-37
hazard_class: IRRITANT
Hazard Classifications: Acute Tox. 4 DermalAcute Tox. 4 InhalationAcute Tox. 4 OralEye Irrit. 2Skin Irrit. 2STOT SE 3
ストレージクラス: 11 - Combustible Solids

化学と産業

用途と製造

U.S. Production2023: <50,000 lb

Industry UsesIntermediate

General Manufacturing Information · 2 件

Photographic Film, Paper, Plate, and Chemical Manufacturing

Benzoic acid, 4-(1,1-dimethylethyl)-, hydrazide: ACTIVE

応用分野

使用4-tert-Butylbenzoic hydrazide was used in the synthesis of 2-(2-methylphenyl)-5-(4-tert-butylphenyl)-1,3,4-oxadiazole.

上流・下流製品情報

上流原料

4-tert-ブチル安息香酸 N,N-ジメチルホルムアミドヒドラジン一塩酸塩ヒドラジン一水和物ジエチルエーテル (無水)塩化スルフィニル 4-tert-ブチル安息香酸メチル 1,4-ジオキサン

サプライヤー100 社

国药集团化学试剂有限公司86-21-63210123 · [email protected]

常州帝通化工有限公司+86-0519-88298848 · [email protected]

梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]

上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]

毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]

化合物ノート

読み込み中…

4-tert-ブチルベンゾヒドラジド

基本情報