4-oxo-5-thiocyanato-pentanoic acid is a chemical compound with the molecular formula C6H7NO2S2. It is an organic compound that features a pentanoic acid backbone, with a carbonyl group (C=O) at the 4th position and a thiocyanate group ( SCN) at the 5th position. 4-oxo-5-thiocyanato-pentanoic acid is characterized by its unique structure, which includes a five-carbon chain with a ketone group and a thiocyanate functional group. The presence of these functional groups gives it specific chemical properties and reactivity, making it potentially useful in various chemical reactions and applications. However, it is important to note that the compound's specific uses, safety, and handling requirements would need to be determined through further research and testing.
5440-64-2
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Basic information
- Product Name: 4-oxo-5-thiocyanato-pentanoic acid
- Synonyms: 4-oxo-5-thiocyanato-pentanoic acid
- CAS NO:5440-64-2
- Molecular Formula: C6H7NO3S
- Molecular Weight: 173.19
- EINECS: N/A
- Product Categories: N/A
- Mol File: 5440-64-2.mol
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Chemical Properties
- Melting Point: N/A
- Boiling Point: 381.7°Cat760mmHg
- Flash Point: 184.7°C
- Appearance: /
- Density: 1.367g/cm3
- Vapor Pressure: 6.94E-07mmHg at 25°C
- Refractive Index: 1.533
- Storage Temp.: N/A
- Solubility: N/A
- PKA: 4.44±0.17(Predicted)
- CAS DataBase Reference: 4-oxo-5-thiocyanato-pentanoic acid(CAS DataBase Reference)
- NIST Chemistry Reference: 4-oxo-5-thiocyanato-pentanoic acid(5440-64-2)
- EPA Substance Registry System: 4-oxo-5-thiocyanato-pentanoic acid(5440-64-2)
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Safety Data
- Hazard Codes: N/A
- Statements: N/A
- Safety Statements: N/A
- WGK Germany:
- RTECS:
- HazardClass: N/A
- PackingGroup: N/A
- Hazardous Substances Data: 5440-64-2(Hazardous Substances Data)
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Check Digit Verification of cas no
The CAS Registry Mumber 5440-64-2 includes 7 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 4 digits, 5,4,4 and 0 respectively; the second part has 2 digits, 6 and 4 respectively.Calculate Digit Verification of CAS Registry Number 5440-64:
(6*5)+(5*4)+(4*4)+(3*0)+(2*6)+(1*4)=82
82 % 10 = 2
So 5440-64-2 is a valid CAS Registry Number.
InChI:InChI=1/C6H7NO3S/c7-4-11-3-5(8)1-2-6(9)10/h1-3H2,(H,9,10)
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5440-64-2Downstream Products
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4-oxo-5-thiocyanato-pentanoic acid
