CAS
946-82-7 Purity
96%
946-82-7 Purity
96%
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1-[4-(Methylthio)pyrimidin-2-yl]hydrazine
CAS
946860-07-7
Catalog Number
ACM946860077
Category
Other Products
Molecular Weight
156.208820 [g/mol]
Molecular Formula
C5H8N4S
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Specification
Synonyms
2-Hydrazinyl-4-(methylthio)pyrimidine;1-[4-(Methylthio)pyrimidin-2-yl]hydrazine
IUPAC Name
(4-methylsulfanylpyrimidin-2-yl)hydrazine
Canonical SMILES
CSC1=NC(=NC=C1)NN
InChI Key
IFWXEWNMYKZJHJ-UHFFFAOYSA-N
Boiling Point
300.7±45.0 °C (760 mmHg)
Melting Point
96-98 °C (chloroform)
Density
1.43±0.1 g/cm³ (20 °C, 760 mmHg)
Exact Mass
156.04700
H-Bond Acceptor
5
H-Bond Donor
2
What is the molecular formula of the compound?
The molecular formula of the compound is C5H8N4S.
What is the molecular weight of the compound?
The molecular weight of the compound is 156.21 g/mol.
What is the IUPAC name of the compound?
The IUPAC name of the compound is (4-methylsulfanylpyrimidin-2-yl)hydrazine.
What is the Canonical SMILES of the compound?
The Canonical SMILES of the compound is CSC1=NC(=NC=C1)NN.
How many hydrogen bond donor counts does the compound have?
The compound has 2 hydrogen bond donor counts.
What is the topological polar surface area of the compound?
The topological polar surface area of the compound is 89.1 Ų.
How many rotatable bond counts does the compound have?
The compound has 2 rotatable bond counts.
Is the compound canonicalized?
Yes, the compound is canonicalized.
What is the XLogP3-AA value of the compound?
The XLogP3-AA value of the compound is 0.6.
When was the compound created and last modified in PubChem?
The compound was created on October 25, 2007, and last modified on December 30, 2023.
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