CAS
929976-32-9 Purity
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929976-32-9 Purity
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Methyl 5-bromo-2-fluoronicotinate
CAS
931105-37-2
Catalog Number
ACM931105372
Category
Bromine Series
Molecular Weight
234.03
Molecular Formula
C7H5BrFNO2
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Specification
Synonyms
methyl 5-bromo-2-fluoronicotinate, 931105-37-2, methyl 5-bromo-2-fluoropyridine-3-carboxylate, PubChem23895, methylbromofluoronicotinate, SureCN3716121, CTK5H2117, MolPort-008-145-888, ANW-64194, SBB098159, ZINC40448866, AKOS005073576, AG-L-25138, MCULE-1657842296, RP13431, AK-26871, BR-26871, KB-78731, AM20061777, FT-0650024
IUPAC Name
methyl 5-bromo-2-fluoropyridine-3-carboxylate
Canonical SMILES
COC(=O)C1=CC(=CN=C1F)Br
InChI Key
QWPLSFRRQYGYTD-UHFFFAOYSA-N
Boiling Point
260.6ºC at 760 mmHg
Flash Point
111.4ºC
Density
1.66g/cm³
Exact Mass
232.94900
H-Bond Acceptor
4
H-Bond Donor
0
What is the molecular formula of Methyl 5-bromo-2-fluoronicotinate?
The molecular formula of Methyl 5-bromo-2-fluoronicotinate is C7H5BrFNO2.
How much is the molecular weight of Methyl 5-bromo-2-fluoronicotinate?
The molecular weight of Methyl 5-bromo-2-fluoronicotinate is 234.02 g/mol.
What is the IUPAC name of Methyl 5-bromo-2-fluoronicotinate?
The IUPAC name of Methyl 5-bromo-2-fluoronicotinate is methyl 5-bromo-2-fluoropyridine-3-carboxylate.
What is the InChI of Methyl 5-bromo-2-fluoronicotinate?
The InChI of Methyl 5-bromo-2-fluoronicotinate is InChI=1S/C7H5BrFNO2/c1-12-7(11)5-2-4(8)3-10-6(5)9/h2-3H,1H3.
What is the InChIKey of Methyl 5-bromo-2-fluoronicotinate?
The InChIKey of Methyl 5-bromo-2-fluoronicotinate is QWPLSFRRQYGYTD-UHFFFAOYSA-N.
What is the canonical SMILES of Methyl 5-bromo-2-fluoronicotinate?
The canonical SMILES of Methyl 5-bromo-2-fluoronicotinate is COC(=O)C1=C(N=CC(=C1)Br)F.
What is the CAS number of Methyl 5-bromo-2-fluoronicotinate?
The CAS number of Methyl 5-bromo-2-fluoronicotinate is 931105-37-2.
What is the EC number of Methyl 5-bromo-2-fluoronicotinate?
The EC number of Methyl 5-bromo-2-fluoronicotinate is 814-534-4.
What is the XLogP3-AA of Methyl 5-bromo-2-fluoronicotinate?
The XLogP3-AA of Methyl 5-bromo-2-fluoronicotinate is 1.8.
Is Methyl 5-bromo-2-fluoronicotinate a canonicalized compound?
Yes, Methyl 5-bromo-2-fluoronicotinate is a canonicalized compound.
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