4-t-Butylbenzenesulfonyl chloride

HCID 139882CAS 15084-51-2

기본 정보

표준 SMILES: CC(C)(C)c1ccc(S(=O)(=O)Cl)cc1
InChIKey: YEZADZMMVHWFIY-UHFFFAOYSA-N
분자식: C10H13ClO2S
평균 분자량: 232.73 g/mol
단동위원소 질량: 232.03247834

이름 및 식별자

우선 이름: 4-t-Butylbenzenesulfonyl chloride
IUPAC: 4-tert-butylbenzenesulfonyl chloride
영어명: 4-tert-Butylbenzenesulfonyl chloride
분자식: C10H13ClO2S
분자량: 232.73

이름 및 동의어

4-t-Butylbenzenesulfonyl chlorideDTXSID70164628NSC 186263RefChem:100493DTXCID4087119YEZADZMMVHWFIY-UHFFFAOYSA-N4-tert-Butylbenzenesulfonyl chloride15084-51-24-(tert-Butyl)benzene-1-sulfonyl chloride4-tert-butylbenzene-1-sulfonyl chloride4-tert-ButylbenzenesulfonylchlorideBenzenesulfonyl chloride, 4-(1,1-dimethylethyl)-

이름 더 보기

TIMTEC-BB SBB006569p-t-Butylbenzenesulfonyl Chloride4-Tetr-Butylbenzenesulfonyl chlorideP-TERT-BUTYL-BENZENESULFONYL CHLORIDE4-TERTBUTYL BENZENE SULFONYLE CHLORIDE4-TERT-BUTYLBENZENESULFONYL CHLORIDE 98%4-tert-Butylbenzenesulfonyl Chloride >

MFCD00007449p-tert-butylbenzenesulfonyl chloride4-tert-butyl phenylsulfonyl chloride4-(tert-butyl)benzenesulfonyl chloride4-tert-butylbenzenesulphonyl chloride4-TERT-BUTYL-BENZENESULFONYL CHLORIDE[4-(tert-butyl)phenyl]chlorosulfonetert-Butylbenzene-4-sulfonyl Chloride;

데이터베이스 식별자

CAS: 15084-51-2
PubChem CID: 139882
DTXSID: DTXSID70164628
EC Number: 629-107-6
Nikkaji: J1.195.000K

물성

구조 계산 물성

XLogP: 3.6
극성 표면적: 42.5 Å²
수소 결합 공여자 수: 0
수소 결합 수용자 수: 2
회전 가능 결합 수: 2
무거운 원자 수: 14
형식 전하: 0
복잡도: 276

물리화학적 성질

녹는점: 78 · 78-81 °C(lit.)
끓는 점: 165 °C · 165 °C / 18mmHg
밀도: 1.206 · 1.2060 (estimate)
저장 조건: Keep in dark place,Inert atmosphere,Room temperature
용해도: 클로로포름(약간 용해됨), 메탄올(약간 용해됨)
물리적 상태: 결정성 분말
색상: 흰색에서 밝은 노란색
BRN: 1104346 · 1104346
InChI: InChI=1S/C10H13ClO2S/c1-10(2,3)8-4-6-9(7-5-8)14(11,12)13/h4-7H,1-3H3
InChIKey: YEZADZMMVHWFIY-UHFFFAOYSA-N
SMILES: C1(S(Cl)(=O)=O)=CC=C(C(C)(C)C)C=C1
NIST: 4 · 4-T-butylbenzenesulfonyl chloride(15084-51-2)

화학적 성질

white to off-white crystals or crystalline powder

안전 및 규제

GHS 분류

GHS Classification · 4건

Danger

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

P260, P264, P264+P265, P280, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P317, P321, P363, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 50 reports by companies from 5 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

유해성 정보

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

안전 데이터

wgk: 3
ridadr: UN 3261 8/PG 2
HS 번호: 29049090
risk_code: 34-29
hazard_code: C
safety_code: 26-27-28-36/37/39-45
포장분류: II
위험 등급: 8
위험 참고 사항: Corrosive
Hazard Classifications: Eye Dam. 1Skin Corr. 1B
스토리지 클래스: 8A - Combustible corrosive hazardous materials

화학 및 산업

응용 분야

용도4-tert-Butylbenzenesulfonyl Chloride can be used to treat cancer.

상·하류 제품 정보

상류 원료

Benzenesulfonic acid,4-(1,1-dimethylethyl)-Benzene,1,1'-sulfonylbis[4-(1,1-dimethylethyl)-1,4-디-4차-부틸벤젠 4-tert-Butylthiophenol 벤젠 1-브로모-4-터셔리-부틸벤젠 클로르아민 T

공급사50 곳

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

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

上海沛灵生物科技有限公司13127581762 13127581762 · [email protected]

湖北永阔科技有限公司027-59223108 15972152991 · [email protected]

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

연결된 노트

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