4-Amino-N-1H-indazol-6-ylbenzenesulfonamide

HCID 83696CAS 13744-68-8
부분 구조 검색유사 구조 찾기

기본 정보

표준 SMILES
Nc1ccc(S(=O)(=O)Nc2ccc3cn[nH]c3c2)cc1
InChIKey
RLNLIVBLEZDLMZ-UHFFFAOYSA-N
분자식
C13H12N4O2S
평균 분자량
288.33 g/mol
단동위원소 질량
288.06809681

이름 및 식별자

우선 이름
4-Amino-N-1H-indazol-6-ylbenzenesulfonamide
IUPAC
4-amino-N-(1H-indazol-6-yl)benzenesulfonamide
영어명
6-Sulfanilamidoindazole
분자식
C13H12N4O2S
분자량
288.33

이름 및 동의어

6-Sulfanilamidoindazole13744-68-8Benzenesulfonamide, 4-amino-N-1H-indazol-6-yl-4-Amino-N-1H-indazol-6-ylbenzenesulfonamideNSC-14072143XC2TRN2RDTXSID50160183RefChem:544323DTXCID8082674237-314-44-amino-n-(1h-indazol-6-yl)benzenesulfonamide6-(Sulfanilamido)indazole
이름 더 보기
TIMTEC-BB SBB001179N1-(6-INDAZOLYL)SULFANILAMIDEN'-(1H-Indazol-6-yl)sulfanilamideN(sup 1)-(6-indazolyl)sulfanilamideNY-(6-INDAZOLYL)SULFANILAMIDE M.P. 193-195OCN1-(6-Indazolyl)sulfanilamide
Sulfanilamide, N1-1H-indazol-6-yl-6-(p-Aminobenzenesulfonylamino)indazole4-amino-N-(1H-indazol-6-yl)benzene-1-sulfonamide1H-indazol-6-yl[(4-aminophenyl)sulfonyl]amineEINECS 237-314-4NSC 140721N-(Indazol-6-yl)-4-aminobenzenesulphonamide4-amino-N-(1H-indazol-6-yl)-benzenesulfonamide

데이터베이스 식별자

CAS
13744-68-8
PubChem CID
83696
DTXSID
DTXSID50160183
UNII
43XC2TRN2R
EC Number
237-314-4
Nikkaji
J278.023B

물성

구조 계산 물성

XLogP
2.1
극성 표면적
109 Ų
수소 결합 공여자 수
3
수소 결합 수용자 수
5
회전 가능 결합 수
3
무거운 원자 수
20

물리화학적 성질

녹는점
193 · 193-195 °C(lit.)
끓는 점
581.1 · 581.1±56.0 °C(Predicted)
밀도
1.546 · 1.546±0.06 g/cm3(Predicted)
산도 계수 (pKa)
8.77 · 8.77±0.30(Predicted)
InChI
1S/C13H12N4O2S/c14-10-2-5-12(6-3-10)20(18,19)17-11-4-1-9-8-15-16-13(9)7-11/h1-8,17H,14H2,(H,15,16)
InChIKey
RLNLIVBLEZDLMZ-UHFFFAOYSA-N

안전 및 규제

GHS 분류

GHS Classification · 5건

Warning

H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]；H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]

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

Aggregated GHS information provided per 39 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.；Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website.

유해성 정보

Hazard Classes and CategoriesSkin Irrit. 2 (100%)；Eye Irrit. 2 (100%)；STOT SE 3 (100%)

안전 데이터

wgk
3
rtecs
DA9510332
risk_code
36/37/38
hazard_code
Xi
safety_code
26
Hazard Classifications
Eye Irrit. 2Skin Irrit. 2STOT SE 3

화학 및 산업

응용 분야

일반 설명N1-(6-Indazolyl)sulfanilamide ( 6-Sulfanilamidoindazole) causes inflammation in the hind paws and ankles of older rat and sensitizes them to the lethal action of endotoxin.

공급사7 곳

杭州摩库生物医药科技有限公司+86-057181025280; +8617767106207 · [email protected]
陕西缔都新材料有限公司029-63373950 17392216152 · [email protected]
上海瀚鸿科技股份有限公司021-54306202 13764082696 · [email protected]
Sigma-Aldrich西格玛奥德里奇(上海)贸易有限公司021-61415566 800-8193336 · [email protected]
BOC Sciences+1-631-485-4226 · [email protected]

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