Basic information
- CAS
4993-93-5- Standard SMILES
CCOC(=O)c1cc2c([N+](=O)[O-])cccc2[nH]1- InChIKey
LXUABEANNNKOLF-UHFFFAOYSA-N- Molecular formula
- C11H10N2O4
- Average molar mass
- 234.21 g/mol
- Monoisotopic mass
- 234.0640568
Names & identifiers
- Preferred name
- Ethyl 4-nitro-1H-indole-2-carboxylate
- IUPAC
- ethyl 4-nitro-1H-indole-2-carboxylate
- English name
- Ethyl 4-nitro-1H-indole-2-carboxylate
- Molecular formula
- C11H10N2O4
- Molecular weight
- 234.21
Names & synonyms
Ethyl 4-nitro-1H-indole-2-carboxylate4993-93-5Ethyl 4-nitroindole-2-carboxylate4-Nitro-indole-2-carboxylic acid ethyl esterETHYL-4-NITROINDOLE-2-CARBOXYLATEMFCD067955124-nitro-1H-indole-2-carboxylic acid ethyl ester1H-Indole-2-carboxylic acid, 4-nitro-, ethyl esterAKOS002838735AS-47735Ethyl 4-nitro-1H-indole-2-carboxylate #NSC137501
Show more names
Ethyl4-nitroindole-2-carboxylate,97%
ETHYL4-NITRO-1H-INDOLE-2-CARBOXYLATESCHEMBL397240DTXSID20300539NSC-137501SY288159DB-3194624-Nitroindole-2-carboxylic acid ethyl esterCS-0453049
Database identifiers
- CAS
4993-93-5- PubChem CID
- 283173
- DTXSID
DTXSID20300539- Nikkaji
- J1.412.468C
Properties
Computed structural properties
- XLogP
- 3
- Topological polar surface area
- 87.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 315
Physicochemical properties
- Melting point
- 227 · 227-229 °C
- Boiling point
- 429.5 · 429.5±25.0 °C(Predicted)
- Density
- 1.393 · 1.393±0.06 g/cm3(Predicted)
- storage temp.
- 2 · 2-8°C
- form
- Solid
- pka
- 12.78 · 12.78±0.30(Predicted)
- color
- Yellow
Chemistry & industry
Upstream & downstream products
Downstream products
Suppliers32 total
上海策嵘生物科技有限公司[email protected]
Career Henan Chemica Co+86-0371-86658258 +86-13203830695 · [email protected]
苏州奥佰医药科技有限公司1483287082 19962651230 · [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]
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]
上海健超生物科技有限公司15021035486 18081542813 · [email protected]
苏州启航生物科技有限公司18151111370
武汉泰凯塞科技有限公司027-86697669 13986148687 · [email protected]
杭州迈世腾药物科技有限公司
Related reactions
19 records
Compound notes
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