CAS
943587-40-4 Purity
96%
943587-40-4 Purity
96%
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4-Pyrimidinamine,6-(2-fluoro-3-pyridinyl)-N-methyl-
CAS
943605-97-8
Catalog Number
ACM943605978
Category
Other Products
Molecular Weight
204.207
Molecular Formula
C10H9FN4
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Specification
Synonyms
6-(2-fluoropyridin-3-yl)-Nmethylpyrimidin-4-amine
IUPAC Name
6-(2-fluoropyridin-3-yl)-N-methylpyrimidin-4-amine
Canonical SMILES
CNC1=NC=NC(=C1)C2=C(N=CC=C2)F
InChI Key
JVFSHHQULXNBJY-UHFFFAOYSA-N
Boiling Point
408.4ºC at 760 mmHg
Flash Point
200.8ºC
Density
1.291g/cm³
Exact Mass
204.08100
H-Bond Acceptor
5
H-Bond Donor
1
What is the molecular formula of the compound 4-Pyrimidinamine,6-(2-fluoro-3-pyridinyl)-N-methyl?
The molecular formula is C10H9FN4.
What is the molecular weight of the compound?
The molecular weight is 204.20 g/mol.
What is the IUPAC name of the compound?
The IUPAC name is 6-(2-fluoropyridin-3-yl)-N-methylpyrimidin-4-amine.
What is the Canonical SMILES representation of the compound?
The Canonical SMILES representation is CNC1=NC=NC(=C1)C2=C(N=CC=C2)F.
What is the InChIKey of the compound?
The InChIKey is JVFSHHQULXNBJY-UHFFFAOYSA-N.
How many hydrogen bond donor counts are there in the compound?
There is 1 hydrogen bond donor count.
How many hydrogen bond acceptor counts are there in the compound?
There are 5 hydrogen bond acceptor counts.
What is the topological polar surface area of the compound?
The topological polar surface area is 50.7 Ų.
Is the compound considered canonicalized?
Yes, the compound is canonicalized.
What is the XLogP3-AA value of the compound?
The XLogP3-AA value is 1.5.
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