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Basic information
- CAS
15720-25-9- Standard SMILES
CC1NC(=O)NC1CCCCCC(=O)O- InChIKey
AUTOLBMXDDTRRT-UHFFFAOYSA-N- Molecular formula
- C10H18N2O3
- Average molar mass
- 214.265 g/mol
- Monoisotopic mass
- 214.13174244
Names & identifiers
- Preferred name
- 6-(5-Methyl-2-oxoimidazolidin-4-yl)hexanoic acid
- IUPAC
- 6-(5-Methyl-2-oxoimidazolidin-4-yl)hexanoic acid
- English name
- desthiobiotin
- Molecular formula
- C10H18N2O3
- Molecular weight
- 214.26
Names & synonyms
X 21Nsc 30855-Methyl-2-oxo-4-imidazolinhexansaeure4-Imidazolidinehexanoic acid, DL-5-methyl-2-oxo-
Database identifiers
- CAS
15720-25-9、636-20-4- PubChem CID
- 643
- DTXSID
DTXSID10862136- ChEMBL
CHEMBL4585840- ChEBI
CHEBI:16691- Nikkaji
- J1.130.931C
Properties
Physicochemical properties
- Melting point
- 162.5 · 162.5-163 °C
- Boiling point
- 476.4 · 476.4±18.0 °C(Predicted)
- Density
- 1.095 · 1.095±0.06 g/cm3(Predicted)
- pka
- 4.77 · 4.77±0.10(Predicted)
- FDA UNII
- 64 P0B487B · I64P0B487B
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H312-H332
- Precautionary statements
- 261 · P261-P264-P270-P271-P280-P301+P312-P302+P352-P304+P340-P330-P363-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-H312-H332
- Precautionary statements
- P261-P264-P270-P271-P280-P301+P312-P302+P352-P304+P340-P330-P363-P501
Chemistry & industry
Applications
Uses6-(5-Methyl-2-oxoimidazolidin-4-yl)hexanoic Acid is a Biotin auxotroph.
Suppliers1 total
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]
Additional notes
DefinitionChEBI: Dethiobiotin is a hexanoic acid having a 5-methyl-2-oxoimidazolidin-4-yl group at the 6-position. It has a role as an Escherichia coli metabolite. It is a monocarboxylic acid, a member of ureas and an imidazolidinone. It is functionally related to a hexanoic acid. It is a conjugate acid of a dethiobiotin(1-).
Related reactions
3 records
Compound notes
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