Basic information
- CAS
3215-45-0- Standard SMILES
CCn1c2ccc(C(=O)O)cc2c2cc(C(=O)O)ccc21- InChIKey
MYFXCPANJUZOOT-UHFFFAOYSA-N- Molecular formula
- C16H13NO4
- Average molar mass
- 283.28 g/mol
- Monoisotopic mass
- 283.0844579
Names & identifiers
- Preferred name
- 9-ethyl-9H-carbazole-3,6-dicarboxylic acid
- IUPAC
- 9-ethylcarbazole-3,6-dicarboxylic acid
- English name
- 9-ethyl-9H-carbazole-3,6-dicarboxylic acid
- Molecular formula
- C16H13NO4
- Molecular weight
- 283.28
Names & synonyms
9-ethyl-9H-carbazole-3,6-dicarboxylic acid3215-45-0DTXSID20396558RefChem:313106DTXCID503474179-ethylcarbazole-3,6-dicarboxylic AcidMFCD009664839-Ethyl-9H-carbazole-3,6-dicarboxylicacid9H-Carbazole-3,6-dicarboxylic acid, 9-ethyl-SCHEMBL8922345SCHEMBL29629312SCHEMBL29629313
Show more names
MYFXCPANJUZOOT-UHFFFAOYSA-NN-ethylcarbazole-3,6-dicarboxylic acidH42636
Database identifiers
- CAS
3215-45-0- PubChem CID
- 3797914
- DTXSID
DTXSID20396558- Nikkaji
- J864.709G
Properties
Computed structural properties
- XLogP
- 2.7
- Topological polar surface area
- 79.5 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 400
Physicochemical properties
- Melting point
- 330 °C · >330 °C
- Boiling point
- 515.7 · 515.7±43.0 °C(Predicted)
- Density
- 1.39 · 1.39±0.1 g/cm3(Predicted)
- storage temp.
- 2 · 2-8°C
- pka
- 3.96 · 3.96±0.30(Predicted)
Chemistry & industry
Suppliers10 total
江苏艾康生物医药研发有限公司025-58851090 19370895928 · [email protected]
上海毕得医药科技股份有限公司400-1647117 13681763483 · [email protected]
杭州摩库生物医药科技有限公司+86-057181025280; +8617767106207 · [email protected]
吉林中科研伸科技有限公司18143011203 · [email protected]
常州创视电子科技有限公司+86 (519) 8829-2061 · [email protected]
苏州朗行生物科技有限公司0512-62968256 18550502935 · [email protected]
河南东元化工科技有限公司16696119288 · [email protected]
郑州汇聚化工有限公司0371-55900031 18137872243 · [email protected]
上海康恩博医药科技有限公司400-1388-521 17510465506 · [email protected]
Jilin Chinese Academy of Sciences-yanshen Technology18143011203 · [email protected]
Related reactions
10 records
Compound notes
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