5-tert-Butyl-4-diethylaminomethyl-2-methyl-furan-3-carboxylic acid
Basic information
- CAS
435341-89-2- Standard SMILES
CCN(CC)Cc1c(C(C)(C)C)oc(C)c1C(=O)O- InChIKey
OSWQMXVRKAMZBC-UHFFFAOYSA-N- Molecular formula
- C15H25NO3
- Average molar mass
- 267.36 g/mol
- Monoisotopic mass
- 267.18344366
Names & identifiers
- Preferred name
- 5-tert-Butyl-4-diethylaminomethyl-2-methyl-furan-3-carboxylic acid
- IUPAC
- 5-tert-butyl-4-(diethylaminomethyl)-2-methylfuran-3-carboxylic acid
- English name
- 5-tert-Butyl-4-diethylaminomethyl-2-methyl-furan-3-carboxylic acid
- Molecular formula
- C15H25NO3
- Molecular weight
- 267.36
Names & synonyms
435341-89-25-tert-Butyl-4-diethylaminomethyl-2-methyl-furan-3-carboxylic acid5-(tert-Butyl)-4-((diethylamino)methyl)-2-methylfuran-3-carboxylic acid5-TERT-BUTYL-4-[(DIETHYLAMINO)METHYL]-2-METHYLFURAN-3-CARBOXYLIC ACIDDTXSID00963025HMS1682G105-tert-butyl-4-(diethylaminomethyl)-2-methylfuran-3-carboxylic acid5-TERT-BUTYL-4-DIETHYLAMINOMETHYL-2-METHYL-FURAN-3-CARBOXYLICACIDAKOS000300810SB61538510739-28-3DB-368843
Show more names
5-tert-Butyl-4-diethylaminomethyl-2-methyl-furan-N-[(2-tert-butyl-5-methyl-3-furanyl)methyl]-N-ethylethanamine
ST50021354AH-487/414315915-tert-butyl-4-[(diethylamino)methyl]-2-methyl-3-furoic acid4-[(diethylamino)methyl]-5-(tert-butyl)-2-methylfuran-3-carboxylic acid5-(tert-Butyl)-4-((diethylamino)methyl)-2-methylfuran-3-carboxylicacid5-tert-butyl-4-(diethylaminomethyl)-2-methyl-furan-3-carboxylic acid
Database identifiers
- CAS
435341-89-2- PubChem CID
- 795304
- DTXSID
DTXSID00963025
Properties
Computed structural properties
- XLogP
- 0.9
- Topological polar surface area
- 53.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 6
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 307
Physicochemical properties
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 261 · P261-P305+P351+P338
- HazardClass
- IRRITANT
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_class
- IRRITANT
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P261-P305+P351+P338
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Related reactions
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Compound notes
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