Completing data — usually done within a minute
Basic information
- Standard SMILES
CNCCCCOc1ccccc1Cc1ccccc1- InChIKey
QSQQPMHPCBLLGX-UHFFFAOYSA-N- Molecular formula
- C18H23NO
- Average molar mass
- 269.388 g/mol
- Monoisotopic mass
- 269.17796436
Names & identifiers
- Preferred name
- Bifemelane
- IUPAC
- 4-(2-Benzylphenoxy)-N-methylbutan-1-amine
- English name
- BIFEMELANE
- Molecular formula
- C18H23NO
- Molecular weight
- 269.38
Names & synonyms
E-0687AlnertMCI-2016CeleportBIFEMELANEBIFEMELANE USP/EP/BP4-(2-BENZYLPHENOXY)-N-METHYLBUTYLAMINEN-Methyl-4-(2-benzylphenoxy)butylamine4-(O-Benzylphenoxy)-N-methylbutylamine4-(2-Benzylphenoxy)-N-Methylbutan-1-aMine
Database identifiers
- CAS
90293-01-9- PubChem CID
- 2377
- DTXSID
DTXSID1045663- ChEMBL
CHEMBL1192517- ChEBI
CHEBI:92338- UNII
- Z4501GN13G
- EC Number
- 692-535-7
- Nikkaji
- J22.043D
Properties
Physicochemical properties
- Boiling point
- 395 ℃ · 395℃
- Density
- 1.006 · 1.006
- Flash point
- 169 ℃ · 169℃
- storage temp.
- 2 · Sealed in dry,2-8°C
- pka
- 10.56 · 10.56±0.10(Predicted)
- FDA UNII
- 4501 GN13G · Z4501GN13G
- ATC code
- 6 AX08 · N06AX08
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302
- Precautionary statements
- 264 · P264-P270-P301+P312-P330-P501
Safety & regulation
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302
- Precautionary statements
- P264-P270-P301+P312-P330-P501
Chemistry & industry
Upstream & downstream products
Upstream raw materials
Suppliers10 total
LGM Pharma1-(800)-881-8210 · [email protected]
武汉易泰科技有限公司上海分公司18930552037 · [email protected]
AdooQ BioScience, LLC+1 (866) 930-6790 · [email protected]
台州川旭医药科技有限公司[email protected] · [email protected]
上海陶术生物科技股份有限公司13564774135 · [email protected]
上海芮晖化工科技有限公司021-31433387 15618786686 · [email protected]
江苏艾康生物医药研发有限公司025-58851090 13913916777 · [email protected]
南京法恩化学有限公司025-85710122 17714198479 · [email protected]
TargetMol中国(陶术生物)4008200310 15002144251 · [email protected]
Dideu Industries Group Limited+8617392712697 · [email protected]
Additional notes
DefinitionChEBI: N-methyl-4-[2-(phenylmethyl)phenoxy]-1-butanamine is a diarylmethane.
Related reactions
0 records
No reaction records under the current filter.
Linked notes
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