CAS
959239-52-2 Purity
96%
959239-52-2 Purity
96%
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4-Chloro-5-ethyl-2-methylpyrimidine
CAS
959239-71-5
Catalog Number
ACM959239715
Category
Other Products
Molecular Weight
156.612760 [g/mol]
Molecular Formula
C7H9ClN2
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Specification
Synonyms
4-Chloro-5-ethyl-2-methylpyrimidine, Ambcb4026638, CTK5H8388, ZINC19091755, 4-Chloro-5-ethyl-2-methyl-pyrimidine, AKOS006283019, AG-H-94422, KB-37974, 959239-71-5
IUPAC Name
4-chloro-5-ethyl-2-methylpyrimidine
Canonical SMILES
CCC1=CN=C(N=C1Cl)C
InChI Key
RHRZSUJCSOWRHN-UHFFFAOYSA-N
Boiling Point
209.1ºC at 760 mmHg
Flash Point
99.8ºC
Density
1.143g/cm³
Exact Mass
156.04500
H-Bond Acceptor
2
H-Bond Donor
0
What is the molecular formula of 4-Chloro-5-ethyl-2-methylpyrimidine?
The molecular formula of 4-Chloro-5-ethyl-2-methylpyrimidine is C7H9ClN2.
When was 4-Chloro-5-ethyl-2-methylpyrimidine created and modified in PubChem?
4-Chloro-5-ethyl-2-methylpyrimidine was created on 2008-01-04 and modified on 2023-12-30 in PubChem.
What is the IUPAC name of 4-Chloro-5-ethyl-2-methylpyrimidine?
The IUPAC name of 4-Chloro-5-ethyl-2-methylpyrimidine is 4-chloro-5-ethyl-2-methylpyrimidine.
What is the InChIKey of 4-Chloro-5-ethyl-2-methylpyrimidine?
The InChIKey of 4-Chloro-5-ethyl-2-methylpyrimidine is RHRZSUJCSOWRHN-UHFFFAOYSA-N.
How many hydrogen bond donor counts does 4-Chloro-5-ethyl-2-methylpyrimidine have?
4-Chloro-5-ethyl-2-methylpyrimidine has 0 hydrogen bond donor counts.
What is the topological polar surface area of 4-Chloro-5-ethyl-2-methylpyrimidine?
The topological polar surface area of 4-Chloro-5-ethyl-2-methylpyrimidine is 25.8 Å^2.
How many rotatable bond counts does 4-Chloro-5-ethyl-2-methylpyrimidine have?
4-Chloro-5-ethyl-2-methylpyrimidine has 1 rotatable bond count.
What is the XLogP3-AA value of 4-Chloro-5-ethyl-2-methylpyrimidine?
The XLogP3-AA value of 4-Chloro-5-ethyl-2-methylpyrimidine is 2.4.
Does 4-Chloro-5-ethyl-2-methylpyrimidine have any defined bond stereocenter count?
No, 4-Chloro-5-ethyl-2-methylpyrimidine does not have any defined bond stereocenter count.
Is 4-Chloro-5-ethyl-2-methylpyrimidine a canonicalized compound in PubChem?
Yes, 4-Chloro-5-ethyl-2-methylpyrimidine is a canonicalized compound in PubChem.
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