Basic information
- CAS
14370-74-2- Standard SMILES
CCOC(=O)c1[nH]c2ccccc2c1O- InChIKey
XSHRJOVZKKCTIU-UHFFFAOYSA-N- Molecular formula
- C11H11NO3
- Average molar mass
- 205.21 g/mol
- Monoisotopic mass
- 205.07389321
Names & identifiers
- Preferred name
- ethyl 3-hydroxy-1H-indole-2-carboxylate
- IUPAC
- ethyl 3-hydroxy-1H-indole-2-carboxylate
- English name
- 3-Hydroxy-1H-indole-2-carboxylic acid ethyl ester
- Molecular formula
- C11H11NO3
- Molecular weight
- 205.21
Names & synonyms
Ethyl 3-hydroxy-1H-indole-2-carboxylate14370-74-2EINECS 238-341-4DTXSID40162499RefChem:138693DTXCID9084990238-341-43-Hydroxy-1h-indole-2-carboxylic acid ethyl esterMFCD006663741356783-40-81H-Indole-2-carboxylic acid, 3-hydroxy-, ethyl ester2-(Ethoxy(hydroxy)methylene)indolin-3-one
Show more names
Indoxylic acid ethyl ester
2-[ethoxy(hydroxy)methylidene]-2,3-dihydro-1H-indol-3-one3-HYDROXY-1H-INDOLE-2-CARBOXYLIC ACID ETHYL ESTER;ETHYL 3-HYDROXY-1H-INDOLE-2-CARBOXYLATE;Einecs 238-341-4P78N9DMB4ESCHEMBL7534562CS-D0362PAA37074AKOS009099786AKOS033222387
Database identifiers
- CAS
14370-74-2- PubChem CID
- 84394
- DTXSID
DTXSID40162499- UNII
- P78N9DMB4E
- EC Number
- 238-341-4
- Nikkaji
- J216.991F
Properties
Computed structural properties
- XLogP
- 2.8
- Topological polar surface area
- 62.3 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 244
Experimental & physicochemical properties
Endocrine DisruptorsPotential endocrine disrupting compound
Physicochemical properties
- Melting point
- 116 °C · 116 °C(Solv: ethanol (64-17-5); water (7732-18-5))
- Boiling point
- 369.5 · 369.5±22.0 °C(Predicted)
- Density
- 1.326 · 1.326
- storage temp.
- 2 · 2-8°C
- pka
- 8.43 · 8.43±0.50(Predicted)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H317
- Precautionary statements
- 280 · P280
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H317
- Precautionary statements
- P280
Chemistry & industry
Suppliers18 total
杭州摩库生物医药科技有限公司+86-057181025280; +8617767106207 · [email protected]
陕西缔都化学有限公司029-029-81123119 17391733320 · [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]
常州科化生物科技有限公司0519-68985668 13685222090 · [email protected]
杰达维（上海）医药科技发展有限公司/J & W PharmLab021-64340559 · [email protected]
武汉凯美克化学科技有限公司027-87342388 18086026008 · [email protected]
上海寰川实业有限公司021-61478794 · [email protected]
成都卡麦尔医药科技有限公司028-67136579 15828051124 · [email protected]
HANGZHOU LEAP CHEM CO., LTD.+86-571-87711850 +86-15355479329 · [email protected]
上海安娅医药科技有限公司19106202509 · [email protected]
江苏艾康生物医药研发有限公司025-66061636 19370895928 · [email protected]
陕西伊坤特医药科技有限公司18049260030 18049260030 · [email protected]
上海美迪西生物医药股份有限公司021-50822001 · [email protected]
上海智乾生物科技有限公司
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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