Basic information
- CAS
57765-22-7- Standard SMILES
CN(C)Cc1c[nH]c2cc(OCc3ccccc3)ccc12- InChIKey
ARPLSLHBKDIBNO-UHFFFAOYSA-N- Molecular formula
- C18H20N2O
- Average molar mass
- 280.4 g/mol
- Monoisotopic mass
- 280.15756326
Names & identifiers
- Preferred name
- 6-Benzyloxygramine
- IUPAC
- N,N-dimethyl-1-(6-phenylmethoxy-1H-indol-3-yl)methanamine
- English name
- 6-Benzyloxygramine
- Molecular formula
- C18H20N2O
- Molecular weight
- 280.36
Names & synonyms
6-Benzyloxygramine57765-22-71-(6-(Benzyloxy)-1H-indol-3-yl)-N,N-dimethylmethanamineN,N-dimethyl-1-(6-phenylmethoxy-1H-indol-3-yl)methanamine1-[6-(benzyloxy)-1h-indol-3-yl]-n,n-dimethylmethanamineMFCD000379346-BENZYLOXY-3-(DIMETHYLAMINOMETHYL)INDOLENSC92545NSC 92545SCHEMBL274611RARECHEM AH BS 0074N,N-dimethyl-6-(phenylmethoxy)-1H-indole-3-methanamine
Show more names
1H-Indole-3-methanamine, N,N-dimethyl-6-(phenylmethoxy)-
DTXSID80293837ARPLSLHBKDIBNO-UHFFFAOYSA-NNSC-92545AKOS0052591173-(dimethylaminomethyl)-6-benzyloxyindoleCS-16532DB-053098CS-0099815
Database identifiers
- CAS
57765-22-7- PubChem CID
- 260808
- DTXSID
DTXSID80293837- Nikkaji
- J2.419.119B
Properties
Computed structural properties
- XLogP
- 3.4
- Topological polar surface area
- 28.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 5
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 314
Physicochemical properties
- Melting point
- 134 · 134-136C
- storage temp.
- -20 °C · -20°C Freezer
- solubility
- DMSO (Slightly), Methanol (Slightly)
- form
- Solid
- color
- Pale Orange
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 261 · P261-P264-P270-P271-P280-P302+P352-P304+P340-P330-P362+P364-P405-P501
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-H315-H319-H335
- Precautionary statements
- P261-P264-P270-P271-P280-P302+P352-P304+P340-P330-P362+P364-P405-P501
Chemistry & industry
Applications
UsesA benzyloxyindole derivative as PPARγ agonist.
Suppliers11 total
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]
北京索莱宝科技有限公司010-50973130 17801761073 · [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]
凯试（上海）科技有限公司021-50135380 · [email protected]
杭州洁汉化工有限公司+86-571-86217390; +8618058761490 · [email protected]
深圳聚合生化科技有限公司+86-400-002-6226 13028896684 · [email protected]
上海皓鸿生物医药科技有限公司400-8210725 4008210725 · [email protected]
上海凯为化学科技有限公司021-58461859 15821823057 · [email protected]
陕西缔都医药有限责任公司81148925 17391631969 · [email protected]
北京百灵威科技有限公司18210857532 18210857532 · [email protected]
烟台盛凯伦化学科技有限公司开发区第一分公司13356901049 · [email protected]
Related reactions
4 records
Compound notes
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