기본 정보
- CAS
14192-26-8- 표준 SMILES
COC(=O)c1ccc2c(c1)NC(=O)C2- InChIKey
YFTGUNWFFVDLNM-UHFFFAOYSA-N- 분자식
- C10H9NO3
- 평균 분자량
- 191.18 g/mol
- 단동위원소 질량
- 191.05824315
이름 및 식별자
- 우선 이름
- 2-Oxindole-6-carboxylic acid methyl ester
- IUPAC
- methyl 2-oxo-1,3-dihydroindole-6-carboxylate
- 현지명
- 메틸2-옥소인돌-6-카르복실레이트
- 영어명
- Methyl 2-oxoindole-6-carboxylate
- 분자식
- C10H9NO3
- 분자량
- 191.18
이름 및 동의어
2-OXO-2,3-DIHYDRO-1H-INDOLE-6-CARBOXYLIC ACID METHYL ESTER2-OXINDOLE-6-CARBOXYLIC ACID METHYL ESTERRefChem:477583687-964-114192-26-8Methyl 2-oxoindoline-6-carboxylateMETHYL OXINDOLE-6-CARBOXYLATEMethyl 2-oxindole-6-carboxylateMETHYL 2-OXO-2,3-DIHYDRO-1H-INDOLE-6-CARBOXYLATE1H-Indole-6-carboxylic acid, 2,3-dihydro-2-oxo-, methyl estermethyl 2-oxo-1,3-dihydroindole-6-carboxylateMFCD03095196
이름 더 보기
메틸2-옥소인돌-6-카르복실레이트6-METHOXYCARBONYL-2-OXINDOLEMethyl 2-indolinone-6-carboxylate2-OXO-6-INDOLINECARBOXYLIC ACID METHYL ESTERNintedanib Intermediate 3Methyl 2-oxindole-6-carbo...2-INDOLINONE-6-METHYLCARBOXYLATE
J55GEX7Z9Z2-Oxoindoline-6-carboxylic acid methyl esterMethyl 2-(2-oxoindolin-6-yl)acetateCS-M2947PB30748AC-22711SY0119262-Oxo-6-indolinecarboxylic Acid Methyl Ester; 6-(Methoxycarbonyl)-2-indolone
데이터베이스 식별자
- CAS
14192-26-8- PubChem CID
- 3734372
- DTXSID
DTXSID50395695- UNII
- J55GEX7Z9Z
- EC Number
- 604-263-8、687-964-1
- Nikkaji
- J2.362.644F
물성
구조 계산 물성
- XLogP
- 0.6
- 극성 표면적
- 55.4 Ų
- 수소 결합 공여자 수
- 1
- 수소 결합 수용자 수
- 3
- 회전 가능 결합 수
- 2
- 무거운 원자 수
- 14
- 형식 전하
- 0
- 복잡도
- 264
물리화학적 성질
- 녹는점
- 184 · 184-190°C
- 끓는 점
- 388.1 · 388.1±42.0 °C(Predicted)
- 밀도
- 1.283 · 1.283±0.06 g/cm3(Predicted)
- 저장 조건
- Sealed in dry,Room Temperature
- 용해도
- 클로로포름(약간 용해됨), 메탄올(약간 용해됨)
- 산도 계수 (pKa)
- 13.5 · 13.50±0.20(Predicted)
- 물리적 상태
- 고체
- 색상
- 흰색에서 황백색까지
- InChI
- InChI=1S/C10H9NO3/c1-14-10(13)7-3-2-6-5-9(12)11-8(6)4-7/h2-4H,5H2,1H3,(H,11,12)
- InChIKey
- YFTGUNWFFVDLNM-UHFFFAOYSA-N
- SMILES
- N1C2=C(C=CC(C(OC)=O)=C2)CC1=O
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 8.5% (4 of 47) of reports.
Warning
H302 (89.4%): Harmful if swallowed [Warning Acute toxicity, oral]
P261, P264, P270, P272, P280, P301+P317, P302+P352, P321, P330, P333+P317, P362+P364, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 47 reports by companies from 6 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Warning
유해성 정보
Regulatory InformationREACH registered substance: 2-Oxo-2,3-dihydro-1H-indol-6-carbonsäuremethylester (EC: 604-263-8)
Hazard Classes and Categories
Acute Tox. 4 (89.4%)
Acute Tox. 4 (100%)
안전 데이터
- wgk
- WGK 3
- HS 번호
- 2933790090
- risk_code
- 36/37/38
- hazard_code
- Xi
- safety_code
- 26-36/37/39
- 위험 참고 사항
- Irritant
- Hazard Classifications
- Acute Tox. 4 OralSkin Sens. 1
- 스토리지 클래스
- 11 - Combustible Solids
화학 및 산업
응용 분야
용도Methyl Oxindole-6-carboxylate is an intermediate used to prepare BIBF 1120, an indolinone as triple angiokinase inhibitors.
상·하류 제품 정보
상류 원료
하류 제품
공급사100 곳
杭州创引化工科技有限公司0571-87012927 13516718938 · [email protected]
T&W GROUP021-61551611 13296011611 · [email protected]
韶远科技（上海）有限公司4000665055 · [email protected]
上海迈瑞尔生化科技有限公司4006356688 18621169109 · [email protected]
北京华威锐科化工有限公司0757-86329057 18934348241 · [email protected]
上海波以尔化工有限公司[email protected]
安耐吉化学&3A（安徽泽升科技股份有限公司）400-0056266 · [email protected]
烟台凯博医药科技有限公司0535-6385396 · [email protected]
武汉凯威斯科技有限公司86-027-67849912 · [email protected]
安庆奇创药业有限公司18061456370 · [email protected]
成都伊诺达博医药科技有限公司028-85105512 18009044761
上海瀚鸿科技股份有限公司021-54306202 13764082696 · [email protected]
常州市淇奥化工有限公司0519-85607258 · [email protected]
上海星酶生物科技有限公司18112588827 · [email protected]
上海泰坦科技股份有限公司4006009262 13023226327 · [email protected]
上海攀鸿化工科技有限公司021-56491756 13512199871 · [email protected]
BOC Sciences1-631-485-4226; 16314854226 · [email protected]
杭州东帆化学有限公司86-0571-85151182
Abblis Chemicals LLC+1-832-373-8299 · [email protected]
南京斯贝源医药科技有限公司+86-25-68710855, +86-25-68710897 · [email protected]
南京维奥化工有限公司Please Send Email 18652950785 · [email protected]
上海乔木化学科技有限公司021-60451683 15021268886 · [email protected]
河南多贝化工有限公司0370-2785118 17550508557 · [email protected]
上海思域化工科技有限公司86-21-34053660 · [email protected]
上海骏晔化工有限公司021-021-50318666 18516602538 · [email protected]
南京诺利斯医药科技有限公司13901585132 · [email protected]
江苏艾康生物医药研发有限公司025-66113011 13913916777 · [email protected]
上海赢瑞生物医药科技有限公司21-33585366 13311639313 · [email protected]
TCI AMERICA800-4238616 · [email protected]
TOKYO CHEMICAL INDUSTRY CO., LTD.03-36680489 · [email protected]
TCI Europe320-37350700 · [email protected]
上海贤鼎生物科技有限公司4009209199 · [email protected]
深圳振强药物研发有限公司0755-66853366 13670046396 · [email protected]
尚科生物医药（上海）有限公司021-68187180 13681683526 · [email protected]
广州爱纯医药科技有限公司020-39119399 18927568969 · [email protected]
CEG Chemical Science & Technology Co., Ltd.Mobile:13665161512
上海昶衍化工科技有限公司021-20242659 18930833303 · [email protected]
重庆福腾医药有限公司18696571988 · [email protected]
杭州迈世腾药物科技有限公司0571-82896630 18969958410 · [email protected]
宁波台康化工有限公司0574-87365517 18074210286 · [email protected]
上海将来实业股份有限公司400-0066400 13621662912 · [email protected]
上海将来实业股份有限公司021-61552785 · [email protected]
成都克莱蒙医药科技有限公司028-87608726 13540107218 · [email protected]
山东轩德医药科技有限公司0531-88803958 19862127196 · [email protected]
重庆星灿医药科技有限公司13594048950 19923294409 · [email protected]
上海卓因生物科技有限公司021-61317773 · [email protected]
凯方医药科技（上海）有限公司021-67220633 021-54824098 · [email protected]
湖南华腾制药有限公司400-8592883 15367835770 · [email protected]
上海御略医药科技有限公司021-60345187 13671753212 · [email protected]
杭州杰恒化工有限公司0571-87396432 · [email protected]
관련 반응
2건
화합물 노트
불러오는 중…