Basic information
- CAS
69047-36-5- Standard SMILES
Cn1ccc2cccc(C=O)c21- InChIKey
JOBIAZYEJOMXEP-UHFFFAOYSA-N- Molecular formula
- C10H9NO
- Average molar mass
- 159.18 g/mol
- Monoisotopic mass
- 159.06841391
Names & identifiers
- Preferred name
- 1-methyl-1H-indole-7-carbaldehyde
- IUPAC
- 1-methylindole-7-carbaldehyde
- English name
- 1H-Indole-7-carboxaldehyde, 1-methyl- (9CI)
- Molecular formula
- C10H9NO
- Molecular weight
- 159.18
Names & synonyms
1-methyl-1H-indole-7-carbaldehyde69047-36-51-methylindole-7-carbaldehyde1H-Indole-7-carboxaldehyde, 1-methyl- (9CI)MFCD111093291-methyl-1H-indole-7-carboxaldehyde1H-Indole-7-carboxaldehyde, 1-methyl-1-methyl-7-formylindoleSCHEMBL690926N-methylindole-7-carboxaldehydeSCHEMBL6212582SCHEMBL29935861
Show more names
JOBIAZYEJOMXEP-UHFFFAOYSA-DTXSID20452921JOBIAZYEJOMXEP-UHFFFAOYSA-NSBB087358AKOS006305839DS-18827SY322810DB-074098
Database identifiers
- CAS
69047-36-5- PubChem CID
- 11040979
- DTXSID
DTXSID20452921- Nikkaji
- J1.885.551H
Properties
Computed structural properties
- XLogP
- 1.5
- Topological polar surface area
- 22 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 1
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 181
Physicochemical properties
- Melting point
- 82 · 82-84 °C
- Boiling point
- 318.7 · 318.7±15.0 °C(Predicted)
- Density
- 1.1 · 1.10±0.1 g/cm3(Predicted)
- storage temp.
- 2 · under inert gas (nitrogen or Argon) at 2-8°C
- Appearance
- White to off-white Solid
- CAS DataBase Reference
- 69047 · 69047-36-5
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 261 · P261-P305+P351+P338
Safety & regulation
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P261-P305+P351+P338
Chemistry & industry
Upstream & downstream products
Upstream raw materials
Suppliers23 total
宁波振岳医药科技有限公司19817745290 · [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]
Aladdin Scientific[email protected]
北京索莱宝科技有限公司010-50973130 17801761073 · [email protected]
Hangzhou Sage Chemical Co., Ltd.+86057186818502 13588463833 · [email protected]
常州科化生物科技有限公司0519-68985668 13685222090 · [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]
赛默飞世尔科技（中国）有限公司800-810-5118 · [email protected]
江苏艾康生物医药研发有限公司025-66028182 17714375163 · [email protected]
九鼎化学（上海）科技有限公司4009209199 · [email protected]
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华诺医药科技(广西)有限公司13005928603 · [email protected]
药明览博(武汉)化学科技有限公司022-59987777 13552403979 · [email protected]
上海皓鸿生物医药科技有限公司400-8210725 4008210725 · [email protected]
宁波振岳医药科技有限公司0086-19817745290; 19817745290 · [email protected]
上海捷世凯生物科技有限公司021-57520305 13795461237 · [email protected]
北京新研汇医药研发有限公司13969155946 · [email protected]
湖北偕丰医药科技有限公司2383948258 19172820304 · [email protected]
珠海奥博凯生物医药技术有限公司400-0628126 · [email protected]
南京药石科技股份有限公司4000255188 13327728092 · [email protected]
Related reactions
17 records
Compound notes
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