Structural formula
Business number | 037A |
---|---|
Molecular formula | C7H8N2O |
Molecular weight | 136.15 |
label |
N-Methyl-3-pyridinecarboxamide, Deacidifier |
Numbering system
CAS number:114-33-0
MDL number:MFCD00006384
EINECS number:204-046-4
RTECS number:None
BRN number:None
PubChem ID:None
Physical property data
None yet
Toxicological data
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Ecological data
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Molecular structure data
5. Molecular property data:
1. Molar refractive index: 37.96
2. Molar volume (m3/mol):123.0
3. Isotonic specific volume (90.2K): 314.5
4. Surface Tension (dyne/cm):42.7
5. Polarizability(10-24cm3):15.05
Compute chemical data
1. Reference value for hydrophobic parameter calculation (XlogP): None
2. Number of hydrogen bond donors: 1
3. Number of hydrogen bond acceptors: 2
4. Number of rotatable chemical bonds: 1
5. Number of tautomers: 2
6. Topological molecule polar surface area 42
7. Number of heavy atoms: 10
8. Surface charge: 0
9. Complexity: 125
10. Number of isotope atoms: 0
11. Determine the number of atomic stereocenters: 0
12. Uncertain number of atomic stereocenters: 0
13. Determine the number of chemical bond stereocenters: 0
14. Number of uncertain chemical bond stereocenters: 0
15. Number of covalent bond units: 1
Properties and stability
None yet
Storage method
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Synthesis method
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Purpose
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