CAS
139305-96-7 Purity
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139305-96-7 Purity
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3-Bromo-2-nitropyridine
CAS
54231-33-3
Catalog Number
ACM54231333
Category
Bromine Series
Molecular Weight
202.99
Molecular Formula
C5H3BrN2O2
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Specification
Synonyms
3-Bromo-2-nitropyridine, 3-Bromo-2-nitro-pyridine, Pyridine, 3-bromo-2-nitro-, ZERO/008660, ZINC02454936, B204, InChI=1/C5H3BrN2O2/c6-4-2-1-3-7-5(4)8(9)10/h1-3, 54231-33-3
IUPAC Name
3-bromo-2-nitropyridine
Canonical SMILES
C1=CC(=C(N=C1)[N+](=O)[O-])Br
InChI Key
WFNISJZUJCKTLT-UHFFFAOYSA-N
Boiling Point
256.9ºC at 760 mmHg
Melting Point
102-104ºC
Flash Point
109.2ºC
Density
1.833 g/cm³
Appearance
light yellow powder
Exact Mass
201.93800
Hazard Statements
T:Toxic;
H-Bond Acceptor
3
H-Bond Donor
0
Packing Group
III
Safety Description
S26-S36/37/39
What is the molecular formula of 3-Bromo-2-nitropyridine?
The molecular formula of 3-Bromo-2-nitropyridine is C5H3BrN2O2.
What is the molecular weight of 3-Bromo-2-nitropyridine?
The molecular weight of 3-Bromo-2-nitropyridine is 202.99 g/mol.
What is the IUPAC name of 3-Bromo-2-nitropyridine?
The IUPAC name of 3-Bromo-2-nitropyridine is 3-bromo-2-nitropyridine.
What is the InChI of 3-Bromo-2-nitropyridine?
The InChI of 3-Bromo-2-nitropyridine is InChI=1S/C5H3BrN2O2/c6-4-2-1-3-7-5(4)8(9)10/h1-3H.
What is the InChIKey of 3-Bromo-2-nitropyridine?
The InChIKey of 3-Bromo-2-nitropyridine is WFNISJZUJCKTLT-UHFFFAOYSA-N.
What is the canonical SMILES of 3-Bromo-2-nitropyridine?
The canonical SMILES of 3-Bromo-2-nitropyridine is C1=CC(=C(N=C1)[N+](=O)[O-])Br.
What is the CAS number of 3-Bromo-2-nitropyridine?
The CAS number of 3-Bromo-2-nitropyridine is 54231-33-3.
What is the European Community (EC) number of 3-Bromo-2-nitropyridine?
The European Community (EC) number of 3-Bromo-2-nitropyridine is 641-347-3.
What is the DSSTox Substance ID of 3-Bromo-2-nitropyridine?
The DSSTox Substance ID of 3-Bromo-2-nitropyridine is DTXSID20344034.
Is 3-Bromo-2-nitropyridine a canonicalized compound in PubChem?
Yes, 3-Bromo-2-nitropyridine is a canonicalized compound in PubChem.
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