Basic information
- CAS
2592-05-4- Standard SMILES
ON=Cc1c[nH]c2ccccc12- InChIKey
BWEFEUTYNRSOKX-UHFFFAOYSA-N- Molecular formula
- C9H8N2O
- Average molar mass
- 160.17 g/mol
- Monoisotopic mass
- 160.06366288
Names & identifiers
- Preferred name
- 1H-Indole-3-carboxaldehyde Oxime
- IUPAC
- N-(1H-indol-3-ylmethylidene)hydroxylamine
- English name
- indole-3-aldehyde oxime
- Molecular formula
- C9H8N2O
- Molecular weight
- 160.17
Names & synonyms
1H-Indole-3-carboxaldehyde oximeRefChem:438722835-799-21H-indole-3-carbaldehyde oxime1H-Indole-3-carboxaldehyde,oximeindole-3-aldoximeMaybridge1_000132ChemDiv2_000193alpha-(indol-3-yl)nitroneMixCom1_000242SCHEMBL2189141SCHEMBL8534525
Show more names
NSC 5258001H-Indole-3-aldoxime3-Indolaldehyde Oximeindole-3-aldehyde oximeIndole-3-carboxaldoximeIndole-3-carboxaldoxime,97%Indole-3-carbaldehyde oxime(Z)-N-(1H-indol-3-ylmethylidene)hydroxylamine(E)-N-[(1H-indol-3-yl)methylidene]hydroxylamineIndole-3-carboxaldoxime (1H-indole-3-carbaldehyde oxime)
SCHEMBL31355128DTXSID301346486HMS2293F17AKOS017263792SY081660DS-002942I1060N-[(1H-indol-3-yl)methylidene]hydroxylamine
Database identifiers
- CAS
2592-05-4- PubChem CID
- 101481
- DTXSID
DTXSID301346486- EC Number
- 835-799-2
Properties
Computed structural properties
- XLogP
- 1.9
- Topological polar surface area
- 48.4 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 181
Physicochemical properties
- Melting point
- 195 °C · 195 °C
- solubility
- Acetone, Dichloromethane, Ethanol, Ethyl Acetate, Methanol
- form
- Solid
- color
- Red
- FDA UNII
- 9 CK5AQH · GXU9CK5AQH
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 315 · H315-H319-H335
- Precautionary statements
- 261 · P261-P280a-P304+P340-P305+P351+P338-P405-P501a
- HS Code
- 2933998090 · 2933998090
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
Warning
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
P264, P264+P265, P280, P302+P352, P305+P351+P338, P321, P332+P317, P337+P317, and P362+P364 (click each P-code to see the statement)
The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesSkin Irrit. 2 (100%)
Safety data
- hs_code
- 2933998090
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H315-H319-H335
- Precautionary statements
- P261-P280a-P304+P340-P305+P351+P338-P405-P501a
Chemistry & industry
Applications
UsesIntermediate in the preparation of Brassinin.
Upstream & downstream products
Upstream raw materials
Suppliers41 total
北京诺德恒信化工技术有限公司010-84929330 13811281791 · [email protected]
郑州汇聚化工有限公司0371-53399770 18037166334 · [email protected]
云南苏理生物医药科技有限公司0871-68355600 18787766125 · [email protected]
杭州摩库生物医药科技有限公司+86-057181025280; +8617767106207 · [email protected]
江苏艾康生物医药研发有限公司025-66061636 19370895928 · [email protected]
上海仲因实业有限公司2537653158 16621191650 · [email protected]
毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]
安耐吉化学&3A（安徽泽升科技有限公司）021-58432009 400-005-6266 · [email protected]
阿法埃莎（中国）化学有限公司400-6106006 · [email protected]
广东方信生物科技有限公司0751-2838688 13376594225 · [email protected]
宝鸡缔都医药化工有限公司029-81145305 17791533577 · [email protected]
天津希恩思生化科技有限公司400 638 7771 · [email protected]
TCI AMERICA800-4238616 · [email protected]
TOKYO CHEMICAL INDUSTRY CO., LTD.03-36680489 · [email protected]
TCI Europe320-37350700 · [email protected]
赛纳斯特化学（欢迎点击联系）021-60343070
凯试（上海）科技有限公司021-50135380 · [email protected]
广东翁江化学试剂有限公司0751-2886766 13927870850 · [email protected]
sgtlifesciences pvt ltd+91-8790379245 · [email protected]
天津康利欣科技有限公司18622939839 · [email protected]
上海麦克林生化科技股份有限公司50706066 15221275939 · [email protected]
大连金点生物科技有限公司0411-0411-00000000 13644282108 · [email protected]
上海炎泽化工有限公司19901447308 19962611955 · [email protected]
Shanghai Daken Advanced Materials Co.,Ltd+86-2158073036 · [email protected]
上海玉函化工有限公司021-61469567 13774476675 · [email protected]
天津希恩思生化科技有限公司400-6387771-6039 18920764717 · [email protected]
上海腾骞生物科技有限公司021-50895067 18616507272;13681616114;15020344067 · [email protected]
武汉赢元贝商贸有限公司86-13349903920 13349903920 · [email protected]
深圳聚合生化科技有限公司+86-400-002-6226 13028896684 · [email protected]
梯希爱(上海)化成工业发展有限公司021-67121386, 800-988-0390 · [email protected]
TCI Chemicals (India) Pvt. Ltd.[email protected]
常州新星联生物科技有限公司+86-0519-85551759 · [email protected]
上海皓鸿生物医药科技有限公司400-8210725 4008210725 · [email protected]
Alchem Pharmtech,Inc.8485655694 · [email protected]
上海迈瑞尔生化科技有限公司18621169109 · [email protected]
上海研邦医药科技有限公司15618536883 · [email protected]
北京百灵威科技有限公司18210857532 18210857532 · [email protected]
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]
Zhengzhou Lingzhiyue Technology Co., Ltd+86-0371-55074660 +86-13523716970 · [email protected]
湖北偕丰医药科技有限公司2383948258 19172820304 · [email protected]
南京世洲生物科技有限公司17301488900 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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