4-tert-Butylbenzoyl chloride (HCID 74372)

이름 및 식별자

우선 이름: 4-tert-Butylbenzoyl chloride
IUPAC: 4-tert-butylbenzoyl chloride
영어명: 4-tert-Butylbenzoyl chloride
분자식: C11H13ClO
분자량: 196.67

이름 및 동의어

4-tert-Butylbenzoyl chloride1710-98-1Benzoyl chloride, 4-(1,1-dimethylethyl)-4-tert-Butylbenzoylchloridep-tert-Butylbenzoyl chlorideMFCD000006954-Tert-ButYl-Benzoyl Chloridep-t-butylbenzoyl chloride4-(tert-butyl)benzoyl chlorideBenzoyl chloride,4-(1,1-dimethylethyl)-4-tert-Butylbenzoic acid chlorideEINECS 216-973-1

이름 더 보기

SKL12794-tert-Butylbenzoylbutylbenzoylchloride4-TERT-BTUYLBENZOYLCHLORIDEBenzoylchloride,p-tert-butyl-4-tert-Butylbenzoyl chloride 98%

4-t-butylbenzoyl chloride4-tertbutylbenzoyl chloride4-t-butyl-benzoyl chloridep-tert.butylbenzoyl chlorideJP27WES49W4-(t-butyl)benzoyl chlorideSCHEMBL38841p-tert.-butylbenzoyl chloride

데이터베이스 식별자

CAS: 1710-98-1
PubChem CID: 74372
DTXSID: DTXSID0061903
UNII: JP27WES49W
EC Number: 216-973-1
Nikkaji: J60.345G

물성

구조 계산 물성

XLogP: 4.8
극성 표면적: 17.1 Å²
수소 결합 공여자 수: 0
수소 결합 수용자 수: 1
회전 가능 결합 수: 2
무거운 원자 수: 13
형식 전하: 0
복잡도: 185

실험 및 물리화학적 성질

Chemical ClassesToxic Gases & Vapors -> Acid Halides

SpringerMaterials PropertiesChemical shift

Physical DescriptionClear very slightly yellow liquid; [Acros Organics MSDS]

물리화학적 성질

녹는점: 177.5 · 177.5-179 °C(Solv: ligroine (8032-32-4); dichloromethane (75-09-2))
끓는 점: 135 °C20 · 135 °C20 mm Hg(lit.)
밀도: 1.007 g/mL · 1.007 g/mL at 25 °C(lit.)
굴절률: 20 · n20/D 1.536(lit.)
인화점: 190 °F · 190 °F
저장 조건: 30 °C · Store below +30°C.
물리적 상태: 액체
색상: 투명하고 무색에서 아주 약간 노란색을 띤다.
수용성: 물과 반응합니다.
BRN: 775793 · 775793
InChI: 1S/C11H13ClO/c1-11(2,3)9-6-4-8(5-7-9)10(12)13/h4-7H,1-3H3
InChIKey: WNLMYNASWOULQY-UHFFFAOYSA-N
SMILES: CC(C)(C)c1ccc(cc1)C(Cl)=O
NIST: 4 · Benzoyl chloride, 4-(1,1-dimethylethyl)-(1710-98-1)
EPA: 4 · Benzoyl chloride, 4-(1,1-dimethylethyl)- (1710-98-1)

화학적 성질

CLEAR COLOURLESS TO VERY SLIGHTLY YELLOW LIQUID

안전 및 규제

GHS 분류

GHS Classification · 4건

Danger

H314 (100%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]

P260, P264, P280, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P321, P363, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 45 reports by companies from 3 notifications to the ECHA C&L Inventory.

유해성 정보

Hazards Summary · 1건

Reacts with water evolving hydrogen chloride; Causes burns; Inhalation may cause corrosive injuries to upper respiratory tract and lungs; Harmful by ingestion, inhalation, and skin absorption; [Acros Organics MSDS] See 4-Chlorobenzoyl chloride.

Hazard Classes and CategoriesSkin Corr. 1B (100%)

독성 정보

Adverse EffectsDermatotoxin - Skin burns.

안전 데이터

wgk: 3
tsca: TSCA listed
ridadr: UN 3265 8/PG 2
HS 번호: 29163900
risk_code: 34-37
hazard_code: C
safety_code: 26-36/37/39-45-24/25
포장분류: II
위험 등급: 8
F 고인화성물질: 9-21
Hazard Classifications: Eye Dam. 1Skin Corr. 1B
스토리지 클래스: 8A - Combustible corrosive hazardous materials

화학 및 산업

용도 및 제조

General Manufacturing InformationBenzoyl chloride, 4-(1,1-dimethylethyl)-: INACTIVE

응용 분야

용도4-tert-Butylbenzoyl chloride is used as a reactant in the preparation of multi-branched structures based on triphenylamine for enhanced two-photon absorption.

일반 설명AlCl3 promoted Friedel-Crafts acylation of 4-tert-butylbenzoyl chloride with mesitylene was investigated.

상·하류 제품 정보

상류 원료

하류 제품

(4-benzylpiperazin-1-yl)(4-(tert-butyl)phenyl)methanone N-(4-아미노페닐)-4-TERT-부틸벤즈아미드 4-tert-butyl-N-[2-(1H-indol-3-yl)ethyl]benzamide 2-[(4-TERT-BUTYLBENZOYL)아미노]-4-(메틸티오)부타노산 (4-TERT-BUTYL-BENZOYLAMINO)-아세트산 4-TERT-부틸-3',4'-디메톡시벤조페논

공급사50 곳

衢州润东化工有限公司0570-8789886 18892685668 · [email protected]

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

陕西格列弗生物科技研究有限责任公司13892423764 · [email protected]

湖北万得化工有限公司15377098680 15377098680 · [email protected]

武汉英诺医药科技有限公司+86-027-59232304 15387063101 · [email protected]

연결된 노트

불러오는 중…

4-tert-Butylbenzoyl chloride

기본 정보