CAS
28733-43-9 Purity
98%
28733-43-9 Purity
98%
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4-Bromo-1H-pyrazole-3-carbonitrile
CAS
288246-16-2
Catalog Number
ACM288246162
Category
Bromine Series
Molecular Weight
171.98
Molecular Formula
C4H2BrN3
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Specification
Synonyms
4-bromo-1H-pyrazole-3-carbonitrile, 288246-16-2, 4-Bromo-2H-pyrazole-3-carbonitrile, 4-Bromopyrazole-3-carbonitrile, 4-Bromo-3-cyano-1H-pyrazole, 4-bromo-1H-pyrazole-5-carbonitrile, AG-E-93146, PubChem10182, ACMC-20aa8h, AC1MC3QG, Maybridge1_006470, SureCN581659, AC1Q24HM, AC1Q25CI, Ambpe2006600, SureCN2386900, KSC497K2J, CTK3J7524, CTK5H0319, HMS559O02
IUPAC Name
4-bromo-1H-pyrazole-5-carbonitrile
Canonical SMILES
C1=NNC(=C1Br)C#N
InChI Key
ZXVFKQRZKKGVNJ-UHFFFAOYSA-N
Boiling Point
412.4ºC at 760mmHg
Melting Point
158ºC
Flash Point
203.2ºC
Density
2.01g/cm³
Appearance
white to light yellow crystal powder
Exact Mass
170.94300
Hazard Statements
Xn:Harmful;
H-Bond Acceptor
2
H-Bond Donor
1
Safety Description
S26-S36/37/39
What is the molecular formula of 4-Bromo-1H-pyrazole-3-carbonitrile?
The molecular formula of 4-Bromo-1H-pyrazole-3-carbonitrile is C4H2BrN3.
What is the molecular weight of 4-Bromo-1H-pyrazole-3-carbonitrile?
The molecular weight of 4-Bromo-1H-pyrazole-3-carbonitrile is 171.98 g/mol.
What is the IUPAC Name of 4-Bromo-1H-pyrazole-3-carbonitrile?
The IUPAC Name of 4-Bromo-1H-pyrazole-3-carbonitrile is 4-bromo-1H-pyrazole-5-carbonitrile.
What is the InChI of 4-Bromo-1H-pyrazole-3-carbonitrile?
The InChI of 4-Bromo-1H-pyrazole-3-carbonitrile is InChI=1S/C4H2BrN3/c5-3-2-7-8-4(3)1-6/h2H,(H,7,8).
What is the InChIKey of 4-Bromo-1H-pyrazole-3-carbonitrile?
The InChIKey of 4-Bromo-1H-pyrazole-3-carbonitrile is ZXVFKQRZKKGVNJ-UHFFFAOYSA-N.
What is the canonical SMILES of 4-Bromo-1H-pyrazole-3-carbonitrile?
The canonical SMILES of 4-Bromo-1H-pyrazole-3-carbonitrile is C1=NNC(=C1Br)C#N.
What is the CAS number of 4-Bromo-1H-pyrazole-3-carbonitrile?
The CAS number of 4-Bromo-1H-pyrazole-3-carbonitrile is 288246-16-2.
What is the EC Number of 4-Bromo-1H-pyrazole-3-carbonitrile?
The EC Number of 4-Bromo-1H-pyrazole-3-carbonitrile is 640-348-6.
Is 4-Bromo-1H-pyrazole-3-carbonitrile a canonicalized compound?
Yes, 4-Bromo-1H-pyrazole-3-carbonitrile is a canonicalized compound.
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