Basic information
- CAS
69321-36-4- Standard SMILES
Cc1cc(=O)oc2cc(OCC(=O)NN)ccc12- InChIKey
UFDAEMFJMQOINV-UHFFFAOYSA-N- Molecular formula
- C12H12N2O4
- Average molar mass
- 248.23 g/mol
- Monoisotopic mass
- 248.07970687
Names & identifiers
- Preferred name
- Acetic acid, ((4-methyl-2-oxo-2H-1-benzopyran-7-yl)oxy)-, hydrazide
- IUPAC
- 2-(4-methyl-2-oxochromen-7-yl)oxyacetohydrazide
- English name
- (4-Methyl-2-oxo-2H-chromen-7-yloxy)-acetic acid hydrazide
- Molecular formula
- C12H12N2O4
- Molecular weight
- 248.23
Names & synonyms
69321-36-4Acetic acid, ((4-methyl-2-oxo-2H-1-benzopyran-7-yl)oxy)-, hydrazideDTXSID90219381RefChem:315983DTXCID101418722-((4-Methyl-2-oxo-2H-chromen-7-yl)oxy)acetohydrazide(4-Methyl-2-oxo-2H-chromen-7-yloxy)-acetic acid hydrazide2-[(4-Methyl-2-oxo-2H-chromen-7-yl)oxy]acetohydrazideMFCD011715542-(4-methyl-2-oxochromen-7-yl)oxyacetohydrazideCHEMBL2178986[(4-Methyl-2-oxo-2H-1-benzopyran-7-yl)oxy]acetic acid hydrazide
Show more names
Acethydrazide, 2-(4-methyl-7-coumarinyloxy)-Coumarin, 4-methyl-7-[2-oxo-2-hydrazinoethoxy]-2-(4-methyl-2-oxo-chromen-7-yl)oxyacetohydrazide2-[(4-methyl-2-oxo-7-chromenyl)oxy]acetohydrazide2-(4-methyl-2-oxo-chromen-7-yl)oxyethanehydrazide2-(2-keto-4-methyl-chromen-7-yl)oxyacetohydrazide(4-Methyl-2-oxo-2H-1-benzopyran-7-yl)oxy]acetic acid hydrazide
2-[(4-Methyl-2-oxo-2H-1-benzopyran-7-yl)oxy]acetohydrazide2-[(4-Methyl-2-oxo-2H-chromen-7-yl)oxy]-acetohydrazideOprea1_446462Oprea1_784269UFDAEMFJMQOINV-UHFFFAOYSA-NBDBM50400134EBC-03712STK871101
Properties
Computed structural properties
- XLogP
- 0.8
- Topological polar surface area
- 90.7 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 3
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 380
Physicochemical properties
- Melting point
- 205 · 205-207 °C
- Boiling point
- 557.8 · 557.8±50.0 °C(Predicted)
- Density
- 1.34 · 1.340±0.06 g/cm3(Predicted)
- pka
- 12.07 · 12.07±0.35(Predicted)
- 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
- hazard_class
- IRRITANT
Chemistry & industry
Suppliers2 total
常州合晶化工有限公司85528066 13775048983 · [email protected]
南京世洲生物科技有限公司025-85563444 15850508050 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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