Basic information
- CAS
99968-74-8- Standard SMILES
Cc1ccc(C(N)=O)o1- InChIKey
HTLIXYXARPLOIU-UHFFFAOYSA-N- Molecular formula
- C6H7NO2
- Average molar mass
- 125.13 g/mol
- Monoisotopic mass
- 125.04767847
Names & identifiers
- Preferred name
- 5-Methylfuran-2-carboxamide
- IUPAC
- 5-methylfuran-2-carboxamide
- English name
- 2-Furancarboxamide,5-methyl-(9CI)
- Molecular formula
- C6H7NO2
- Molecular weight
- 125.13
Names & synonyms
5-methylfuran-2-carboxamide99968-74-8DTXSID70409081RefChem:304267DTXCID90359933818-927-15-METHYL-2-FURANCARBOXAMIDE2-Furancarboxamide, 5-methyl-MFCD01921939A1CD0SCHEMBL279424SCHEMBL18547147
Show more names
HTLIXYXARPLOIU-UHFFFAOYSA-NZDA968742-Furancarboxamide,5-methyl-(9CI)STK358677AKOS003884763amide of 5-methylfuran-2-carboxylic acidBS-51063DB-281544
Database identifiers
- CAS
99968-74-8- PubChem CID
- 5166334
- DTXSID
DTXSID70409081- EC Number
- 818-927-1
- Nikkaji
- J2.738.794B
Properties
Computed structural properties
- XLogP
- 0.6
- Topological polar surface area
- 56.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 9
- Formal charge
- 0
- Complexity
- 124
Physicochemical properties
- Melting point
- 131 · 131-132 °C
- Boiling point
- 222.4 · 222.4±28.0 °C(Predicted)
- Density
- 1.167 · 1.167±0.06 g/cm3(Predicted)
- pka
- 15.87 · 15.87±0.50(Predicted)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 261 · P261-P264-P270-P271-P280-P301+P312-P302+P352-P304+P340-P305+P351+P338-P330-P332+P313-P337+P313-P362-P403+P233-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.
GHS classification
GHS Classification
Warning
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesAcute Tox. 4 (100%)
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P261-P264-P270-P271-P280-P301+P312-P302+P352-P304+P340-P305+P351+P338-P330-P332+P313-P337+P313-P362-P403+P233-P405-P501
Chemistry & industry
Upstream & downstream products
Upstream raw materials
Suppliers14 total
毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]
上海腾准生物科技有限公司19821570922 · [email protected]
上海毕得医药科技股份有限公司400-1647117 13681763483 · [email protected]
江苏艾康生物医药研发有限公司025-66061636 19370895928 · [email protected]
北京索莱宝科技有限公司010-50973130 17801761073 · [email protected]
菏泽博纳医药科技有限公司15865805009 · [email protected]
郑州为易化工产品有限公司0371-88888888 qq272369594;2159423853qq · [email protected]
广东翁江化学试剂有限公司0751-2815987 13927875076 · [email protected]
上海瀚思化工有限公司18916268197 · [email protected]
上海康恩博医药科技有限公司（科小研试剂）400-1388-521 17510465506 · [email protected]
上海皓鸿生物医药科技有限公司400-8210725 4008210725 · [email protected]
上海捷世凯生物科技有限公司021-57520305 13795461237 · [email protected]
Related reactions
1 records
Compound notes
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