4-나이트로벤젠설포닐 염화물

4-Nitrobenzenesulfonyl chloride

HCID 7404CAS 98-74-8
부분 구조 검색유사 구조 찾기

기본 정보

표준 SMILES
O=[N+]([O-])c1ccc(S(=O)(=O)Cl)cc1
InChIKey
JXRGUPLJCCDGKG-UHFFFAOYSA-N
분자식
C6H4ClNO4S
평균 분자량
221.62 g/mol
단동위원소 질량
220.95495629

개요

used to detect and characterize trace amounts of biologically active steroids, such as estrogens, androgens and neuroactive steroids; structure in first source

이름 및 식별자

우선 이름
4-Nitrobenzenesulfonyl chloride
IUPAC
4-nitrobenzenesulfonyl chloride
현지명
4-나이트로벤젠설포닐 염화물
영어명
4-Nitrobenzenesulfonyl chloride
분자식
C6H4ClNO4S
분자량
221.62

이름 및 동의어

4-Nitrobenzenesulfonyl chloride98-74-8Benzenesulfonyl chloride, 4-nitro-4-Nitrobenzenesulphonyl chlorideP-NITROBENZENESULFONYL CHLORIDEBenzenesulfonyl chloride, p-nitro-AI3-52248NSC-13065ZU5JD6BHB3DTXSID4059178NBSO2ClRefChem:565055
이름 더 보기
4-나이트로벤젠설포닐염화물4-나이트로벤젠설포닐염화물4-니트로벤젠설포닐클로라이드NsClNosylchloride4-NSCl, 99%min4-NitrobenzenesuL4-Nitrobenzenesulfonnosyl ch202-697-9loride
DTXCID1049061202-697-94-nitrobenzene-1-sulfonyl chloride4-Nitrobenzenesulfonylchloride4-Nitrophenylsulfonyl chloride4-nitrobenzenesulphonylchloridep-Nitrophenylsulfonyl chloride4-Nitrobenzenesulfonic acid chloride

데이터베이스 식별자

CAS
98-74-8
PubChem CID
7404
DTXSID
DTXSID4059178
ChEMBL
CHEMBL4753649
UNII
ZU5JD6BHB3
EC Number
202-697-9
Nikkaji
J145.068I

물성

구조 계산 물성

XLogP
2.1
극성 표면적
88.3 Ų
수소 결합 공여자 수
0
수소 결합 수용자 수
4
회전 가능 결합 수
1
무거운 원자 수
13

실험 및 물리화학적 성질

Chemical ClassesNitrogen Compounds -> Other Aromatics (Nitrogen)
SpringerMaterials PropertiesChemical shift
Physical DescriptionLight yellow crystalline powder; [Alfa Aesar MSDS]

물리화학적 성질

녹는점
75 °C · 75 °C
끓는 점
143 · 143-144 °C (1.5002 mmHg)
밀도
1.602 · 1.602 (estimate)
증기압
0.009 Pa · 0.009Pa at 20℃
굴절률
1.6 · 1.6000 (estimate)
인화점
143 · 143-144°C/1.5mm

화학적 성질

yellow to brown powder

안전 및 규제

GHS 분류

GHS Classification · 5건

This chemical does not meet GHS hazard criteria for 1.5% (1 of 67) of reports.

Danger

H314 (95.5%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]

P260, P261, P264, P272, P280, P301+P330+P331, P302+P352, P302+P361+P354, P304+P340, P305+P354+P338, P316, P321, P333+P317, P362+P364, P363, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 67 reports by companies from 12 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

유해성 정보

Regulatory Information · 2건

Status: Cease Manufacture Update: 07-12-2018 https://echa.europa.eu/registration-dossier/-/registered-dossier/27400

4-Nitrobenzenesulphonyl chloride: Does not have an individual approval but may be used under an appropriate group standard

Hazards SummarySlowly hydrolyzed by water; Causes burns; Inhalation may cause corrosive injuries to upper respiratory tract and lungs; [Alfa Aesar MSDS] See 2-Nitrobenzenesulfonyl chloride.
Hazard Classes and CategoriesSkin Corr. 1B (95.5%)

독성 정보

Adverse EffectsDermatotoxin - Skin burns.

안전 데이터

wgk
3
tsca
TSCA listed
ridadr
UN 3261 8/PG 2
HS 번호
29049085
risk_code
34-52/53
hazard_code
C

화학 및 산업

용도 및 제조

General Manufacturing InformationBenzenesulfonyl chloride, 4-nitro-: ACTIVE

응용 분야

용도4-Nitrobenzenesulfonyl Chloride is used in the preparation of N-Nosyl-α-amino acid for peptide synthesis.

제조 방법

생산 방법4,4'-Dinitrodiphenyldisulfide [100-32-3], produced by reaction of 4-chloronitrobenzene with sodium disulfide, is treated with chlorine in HCl – HNO3 by a process similar to that used for 2-nitrobenzenesulfonyl chloride.

상·하류 제품 정보

공급사50 곳

阿诺西（上海）生物技术有限公司400-1107768 15058188853 · [email protected]
河南斯维茵医药科技有限责任公司13072124697 18837373888
温州共赢化学有限公司+86-0086-577-64498589 +86-15355981851 · [email protected]
上海泰矶林实业有限公司02150630626 17717886015 · [email protected]
Baoji Guokang Healthchem co.,ltd+8615604608665 15604608665 · [email protected]

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