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7-ethyl-2,3-dihydro-1H-indole-2,3-dione

HCID 247365
NotesReactions
Basic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

CAS
79183-65-6
Standard SMILES
CCc1cccc2c1NC(=O)C2=O
InChIKey
YMZGAPGIOFRUFU-UHFFFAOYSA-N
Molecular formula
C10H9NO2
Average molar mass
175.18 g/mol
Monoisotopic mass
175.06332853

Names & identifiers

Preferred name
7-ethyl-2,3-dihydro-1H-indole-2,3-dione
IUPAC
7-ethyl-1H-indole-2,3-dione
English name
7-Ethylisatin
Molecular formula
C10H9NO2
Molecular weight
175.18

Names & synonyms

7-ethyl-2,3-dihydro-1H-indole-2,3-dioneRefChem:546343851-318-97-Ethylisatin79183-65-67-Ethylindoline-2,3-dione7-ethyl-1H-indole-2,3-dione1H-Indole-2,3-dione,7-ethyl-MFCD00047222NSC61828MLS0026933481H-Indole-2,3-dione, 7-ethyl-
Show more names
7-Ethyl-1H-indol-2,3-dione7-ethyl-1H-indole-2,3-dione(SALTDATA: FREE)
7-Ethyl-1H-indole-2,3-dione >98%SCHEMBL951019CHEMBL1878755DTXSID80289533YMZGAPGIOFRUFU-UHFFFAOYSA-NHMS3079F11ALBB-002985ALD-N000069

Database identifiers

CAS
79183-65-6
PubChem CID
247365
DTXSID
DTXSID80289533
ChEMBL
CHEMBL1878755
EC Number
851-318-9
Nikkaji
J1.079.015H

Properties

Computed structural properties

XLogP
1.5
Topological polar surface area
46.2 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
2
Rotatable bonds
1
Heavy atoms
13
Formal charge
0
Complexity
249

Physicochemical properties

Melting point
193 °C · 193 °C(Solv: ethanol (64-17-5))
Density
1.247 · 1.247±0.06 g/cm3(Predicted)
storage temp.
Sealed in dry,Room Temperature
pka
9.86 · 9.86±0.20(Predicted)
Symbol(GHS)
7 · GHS07
Signal word
Warning
Hazard statements
302 · H302-H315-H319-H335
Precautionary statements
261 · P261-P305+P351+P338
HazardClass
IRRITANT
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 · 5 items

Warning

H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral];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, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (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 CategoriesAcute Tox. 4 (100%);Skin Irrit. 2 (100%);Eye Irrit. 2A (100%);STOT SE 3 (100%)

Safety data

hs_code
2933998090
Signal word
Warning
Symbol(GHS)
GHS07
hazard_class
IRRITANT
Hazard statements
H302-H315-H319-H335
Precautionary statements
P261-P305+P351+P338

Chemistry & industry

Applications

Uses7-Ethyl-1H-indole-2,3-dione is used in the synthetic preparation of substituted indolin-2-ones as p90 ribosomal s6 protein kinase 2 (RSK2) inhibitors.

Upstream & downstream products

Upstream raw materials

(2E)-N-(2-Ethylphenyl)-2-(hydroxyimino)acetamide

Downstream products

7-Ethyl tryptophol

Suppliers34 total

Hangzhou Milon Pharmatech Co.,Ltd.+86-18083715844 · [email protected]
上海毕得医药科技股份有限公司400-1647117 13681763483 · [email protected]
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]
陕西德莱维特生物科技有限公司15780788769 18292741956 · [email protected]
北京华威锐科化工有限公司0757-86329057 18934348241 · [email protected]
武汉凯威斯科技有限公司86-027-67849912 · [email protected]
常州科化生物科技有限公司0519-68985668 13685222090 · [email protected]
烟台盛凯伦生物制品有限公司13356901049 · [email protected]
砌块化学科技(上海)有限公司021-20432219 13918097649 · [email protected]
贵州易妥化学科技有限公司18628235590 · [email protected]
PT CHEM GROUP LIMITED+86-85511178; +86-85511178 · [email protected]
上海安米克化学品有限公司微信 17321281695 18019252918 · [email protected]
AN PharmaTech Co Ltd86(21)68097365 · [email protected]
成都赛诺宁科技有限公司28-87999436 02887999436 · [email protected]
常州施力医药科技有限公司051988727299; 13961229012 · [email protected]
HANGZHOU LEAP CHEM CO., LTD.+86-571-87711850 +86-15355479329 · [email protected]
南京博米尔生物科技有限公司025-83453382-8005 · [email protected]
常州合晶化工有限公司85528066 13775048983 · [email protected]
烟台盛凯伦化学科技有限公司13356901049 · [email protected]
上海林栎生物科技有限公司13761635123 · [email protected]
济宁一泽医药科技有限公司15192473210 · [email protected]
Capot Chemical Co.,Ltd.+86-(0)57185586718 +86-13336195806 · [email protected]
江苏艾康生物医药研发有限公司025-66113011 19370895928 · [email protected]
XIAMEN AMITY INDUSTRY AND TRADE CO., LTD.+8618950047208 · [email protected]
Alchem Pharmtech,Inc.8485655694 · [email protected]
济南光尘医药科技有限公司18563726319 · [email protected]
南京康满林化工实业有限公司025-83697070 13770331960 · [email protected]
上海藜筠生物科技有限公司13119135307
武汉万鉴生物科技有限公司13277087647 · [email protected]
北京新研汇医药研发有限公司13969155946 · [email protected]
Hefei TNJ Chemical Industry Co.,Ltd.+86-0551-65418684 +86-18949823763 · [email protected]
湖北偕丰医药科技有限公司2383948258 19172820304 · [email protected]
AFINE CHEMICALS LIMITED+86-571-85134551 +86-18958018566 · [email protected]
杭州米龙生物科技有限公司18083715844 · [email protected]

Related reactions

5 records
New reaction record
HRID 251962 reaction equation
HRID 251962As reactantuspto-grants-2011_01
HRID 938139 reaction equation
HRID 938139As reactantValidation data from https://doi.org/10.1039/C8SC04228D
HRID 1297755 reaction equation
HRID 1297755As reactantuspto-grants-2007_07
HRID 2375517 reaction equation
HRID 2375517As reactantuspto-grants-2008_12
HRID 2427072 reaction equation
HRID 2427072As reactantuspto-grants-2011_06

Compound notes

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On this pageBasic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes