CAS
944899-25-6 Purity
96%
944899-25-6 Purity
96%
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4-Nitronicotinaldehyde
CAS
944899-52-9
Catalog Number
ACM944899529
Category
Other Products
Molecular Weight
152.107560 [g/mol]
Molecular Formula
C6H4N2O3
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Specification
Synonyms
4-NITRONICOTINALDEHYDE, AG-H-90184, 944899-52-9, CTK5H6709, AKOS006303634, AB58414, 4-NITRO-PYRIDINE-3-CARBALDEHYDE
IUPAC Name
4-nitropyridine-3-carbaldehyde
Canonical SMILES
C1=CN=CC(=C1[N+](=O)[O-])C=O
InChI Key
JOCNJQYXCDLGRQ-UHFFFAOYSA-N
Boiling Point
324.6ºC at 760 mmHg
Flash Point
150.1ºC
Density
1.432g/cm³
Exact Mass
152.02200
H-Bond Acceptor
4
H-Bond Donor
0
What is the molecular formula of 4-Nitronicotinaldehyde?
The molecular formula of 4-Nitronicotinaldehyde is C6H4N2O3.
What is the molecular weight of 4-Nitronicotinaldehyde?
The molecular weight of 4-Nitronicotinaldehyde is 152.11 g/mol.
What is the IUPAC name of 4-Nitronicotinaldehyde?
The IUPAC name of 4-Nitronicotinaldehyde is 4-nitropyridine-3-carbaldehyde.
What is the InChI of 4-Nitronicotinaldehyde?
The InChI of 4-Nitronicotinaldehyde is InChI=1S/C6H4N2O3/c9-4-5-3-7-2-1-6(5)8(10)11/h1-4H.
What is the InChIKey of 4-Nitronicotinaldehyde?
The InChIKey of 4-Nitronicotinaldehyde is JOCNJQYXCDLGRQ-UHFFFAOYSA-N.
What is the canonical SMILES of 4-Nitronicotinaldehyde?
The canonical SMILES of 4-Nitronicotinaldehyde is C1=CN=CC(=C1[N+](=O)[O-])C=O.
What is the CAS number of 4-Nitronicotinaldehyde?
The CAS number of 4-Nitronicotinaldehyde is 944899-52-9.
What is the XLogP3-AA value of 4-Nitronicotinaldehyde?
The XLogP3-AA value of 4-Nitronicotinaldehyde is 0.1.
How many hydrogen bond acceptor count does 4-Nitronicotinaldehyde have?
4-Nitronicotinaldehyde has 4 hydrogen bond acceptor count.
How many rotatable bond count does 4-Nitronicotinaldehyde have?
4-Nitronicotinaldehyde has 1 rotatable bond count.
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