기본 정보
- CAS
68083-38-5- 표준 SMILES
CC1=NN(c2cccc(S(=O)(=O)O)c2)C(=N)C1- InChIKey
INHXSMASASFALB-UHFFFAOYSA-N- 분자식
- C10H11N3O3S
- 평균 분자량
- 253.28 g/mol
- 단동위원소 질량
- 253.05211239
이름 및 식별자
- 우선 이름
- Benzenesulfonic acid, 3-(4,5-dihydro-5-imino-3-methyl-1H-pyrazol-1-yl)-
- IUPAC
- 3-(5-imino-3-methyl-4H-pyrazol-1-yl)benzenesulfonic acid
- 영어명
- m-(4,5-dihydro-5-imino-3-methyl-1H-pyrazol-1-yl)benzenesulphonic acid
- 분자식
- C10H11N3O3S
- 분자량
- 253.28
이름 및 동의어
68083-38-5m-(4,5-Dihydro-5-imino-3-methyl-1H-pyrazol-1-yl)benzenesulphonic acidBenzenesulfonic acid, 3-(4,5-dihydro-5-imino-3-methyl-1H-pyrazol-1-yl)-EINECS 268-387-03-(3-Methyl-5-imino-2-pyrazolin-1-yl)benzenesulfonic acidDTXSID90710563-(4,5-Dihydro-5-imino-3-methyl-1H-pyrazol-1-yl)benzenesulfonic acidRefChem:564307DTXCID3045489268-387-03-(5-Imino-3-methyl-4,5-dihydro-1H-pyrazol-1-yl)benzenesulfonic acid3-(5-imino-3-methyl-4H-pyrazol-1-yl)benzenesulfonic acid
이름 더 보기
m-Sulfonamidopyrazole3-METHYL-1-(3-SULFOPHENYL) PYRAZOLIMINE1-(3'-sulfon Phenyl)-3-Methyl-5-Amino Pyrazole1-(3 Sulfophenyl) – 3 Methyl – 5 Imino Pyrazole3-(5-IMINO-3-METHYL-2-PYRAZOLIN-1-YL)BENZENESULFONIC ACID3-(3-METHYL-5-IMONO-2-PYRAZOLIN-1-YL) BENZENESULFONIC ACID3-(3-Methyl-5-imino-2-pyrazolin-1-yl) benzenesulfonic acidm-(4,5-Dihydro-5-imino-3-methyl-1H-pyrazol-1-yl)benzolsulfonsure
3-(5-imino-3-methyl-4,5-dihydro-1H-pyrazol-1-yl)benzene-1-sulfonic acid5GAV2X3U9VSCHEMBL6522501INHXSMASASFALB-UHFFFAOYSA-NAKOS024335088NS00022668
물성
구조 계산 물성
- XLogP
- 0.1
- 극성 표면적
- 102 Ų
- 수소 결합 공여자 수
- 2
- 수소 결합 수용자 수
- 5
- 회전 가능 결합 수
- 2
- 무거운 원자 수
- 17
- 형식 전하
- 0
- 복잡도
- 452
물리화학적 성질
- 끓는 점
- 443.69 ℃[at · 443.69℃[at 101 325 Pa]
- 밀도
- 1.52 · 1.52[at 20℃]
- 증기압
- 0 Pa · 0Pa at 25℃
- 수용성
- 10.52 g/L · 10.52g/L at 25℃
- LogP
- -1.95 at · -1.95 at 25℃
- EPA
- 3 · Benzenesulfonic acid, 3-(4,5-dihydro-5-imino-3-methyl-1H-pyrazol-1-yl)- (68083-38-5)
안전 및 규제
안전 정보는 참고용이며, 공급업체의 물질안전보건자료(SDS), 관련 법규 및 전문가 평가를 대체하지 않습니다.
GHS 분류
GHS Classification
This chemical does not meet GHS hazard criteria for 5% (2 of 40) of reports.
Warning
H315 (95%): Causes skin irritation [Warning Skin corrosion/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 40 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Warning
유해성 정보
Regulatory Information
Chemical: Benzenesulfonic acid, 3-(4,5-dihydro-5-imino-3-methyl-1H-pyrazol-1-yl)-
REACH registered substance: m-(4,5-dihydro-5-imino-3-methyl-1H-pyrazol-1-yl)benzenesulphonic acid (EC: 268-387-0)
Hazard Classes and Categories
Skin Irrit. 2 (95%)
Skin Irrit. 2 (100%)
안전 데이터
- tsca
- TSCA listed
화학 및 산업
용도 및 제조
General Manufacturing InformationBenzenesulfonic acid, 3-(4,5-dihydro-5-imino-3-methyl-1H-pyrazol-1-yl)-: ACTIVE
공급사10 곳
宁波君龙新材料有限公司0574 88552218 18969899212 · [email protected]
温州共赢化学有限公司+86-0086-577-64498589 +86-15355981851 · [email protected]
宁波台康化工有限公司0574-87365517 18074210286 · [email protected]
普善实业（陕西）有限公司029-81310890 18165209495 · [email protected]
陕西缔都医药化工有限公司029-029-81120477 17792793610 · [email protected]
XIAMEN AMITY INDUSTRY AND TRADE CO., LTD.+8618950047208 · [email protected]
Henan Yufu New Materials Co.,Ltd[email protected]
广州市禄涞医药科技有限公司13660253774 · [email protected]
武汉裕清嘉衡药业有限公司027-83855312 17771813295 13377865312 · [email protected]
山东彬睿特新材料有限公司0533-2866658 15615638350 · [email protected]
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