CAS
933682-80-5 Purity
96%
933682-80-5 Purity
96%
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5-Bromo-6-methyl-4-pyrimidinecarboxylic acid
CAS
933683-74-0
Catalog Number
ACM933683740
Category
Other Products
Molecular Weight
217.020100 [g/mol]
Molecular Formula
C6H5BrN2O2
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Specification
Synonyms
5-Bromo-6-methylpyrimidine-4-carboxylic acid, 933683-74-0, QC-8446, AK137937, KB-245272
IUPAC Name
5-bromo-6-methylpyrimidine-4-carboxylic acid
Canonical SMILES
CC1=NC=NC(=C1Br)C(=O)O
InChI Key
QQRJUUXEDOXYTB-UHFFFAOYSA-N
Exact Mass
215.95300
H-Bond Acceptor
4
H-Bond Donor
1
What is the molecular formula of 5-Bromo-6-methyl-4-pyrimidinecarboxylic acid?
The molecular formula is C6H5BrN2O2.
What are the synonyms of 5-Bromo-6-methyl-4-pyrimidinecarboxylic acid?
The synonyms are 5-Bromo-6-methylpyrimidine-4-carboxylic acid, 933683-74-0, 5-bromo-6-methyl-4-Pyrimidinecarboxylic acid, DTXSID10856777, SB59133.
What is the molecular weight of 5-Bromo-6-methyl-4-pyrimidinecarboxylic acid?
The molecular weight is 217.02 g/mol.
What is the IUPAC name of 5-Bromo-6-methyl-4-pyrimidinecarboxylic acid?
The IUPAC name is 5-bromo-6-methylpyrimidine-4-carboxylic acid.
What is the InChI of 5-Bromo-6-methyl-4-pyrimidinecarboxylic acid?
The InChI is InChI=1S/C6H5BrN2O2/c1-3-4(7)5(6(10)11)9-2-8-3/h2H,1H3,(H,10,11).
What is the InChIKey of 5-Bromo-6-methyl-4-pyrimidinecarboxylic acid?
The InChIKey is QQRJUUXEDOXYTB-UHFFFAOYSA-N.
What is the canonical SMILES of 5-Bromo-6-methyl-4-pyrimidinecarboxylic acid?
The canonical SMILES is CC1=C(C(=NC=N1)C(=O)O)Br.
What is the CAS number of 5-Bromo-6-methyl-4-pyrimidinecarboxylic acid?
The CAS number is 933683-74-0.
What is the XLogP3-AA value of 5-Bromo-6-methyl-4-pyrimidinecarboxylic acid?
The XLogP3-AA value is 1.2.
Is 5-Bromo-6-methyl-4-pyrimidinecarboxylic acid a canonicalized compound?
Yes, it is a canonicalized compound.
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