CAS
915924-97-9 Purity
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915924-97-9 Purity
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3-(Chloromethyl)-5-cyclopentyl-1,2,4-oxadiazole
CAS
915925-39-2
Catalog Number
ACM915925392
Category
Other Products
Molecular Weight
186.638740 [g/mol]
Molecular Formula
C8H11ClN2O
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Specification
Synonyms
3-(CHLOROMETHYL)-5-CYCLOPENTYL-1,2,4-OXADIAZOLE, 915925-39-2, Ambcb4017811, CTK5H0175, MolPort-011-492-268, ZINC19090795, AKOS009251629, AB48373, AG-H-76202
IUPAC Name
3-(chloromethyl)-5-cyclopentyl-1,2,4-oxadiazole
Canonical SMILES
C1CCC(C1)C2=NC(=NO2)CCl
InChI Key
AIMLZTHNVMYLOQ-UHFFFAOYSA-N
Boiling Point
292ºC at 760 mmHg
Flash Point
130.4ºC
Density
1.245g/cm³
Exact Mass
186.05600
H-Bond Acceptor
3
H-Bond Donor
0
What is the molecular formula of the compound with PubChem CID 28064194?
The molecular formula is C8H11ClN2O.
What is the IUPAC name of the compound?
The IUPAC name is 3-(chloromethyl)-5-cyclopentyl-1,2,4-oxadiazole.
What is the molecular weight of the compound?
The molecular weight is 186.64 g/mol.
What is the CAS number of the compound?
The CAS number is 915925-39-2.
How many hydrogen bond donor counts does the compound have?
The compound has 0 hydrogen bond donor counts.
What is the XLogP3-AA value of the compound?
The XLogP3-AA value is 2.2.
What is the exact mass of the compound?
The exact mass is 186.0559907 g/mol.
How many rotatable bond counts does the compound have?
The compound has 2 rotatable bond counts.
What is the topological polar surface area of the compound?
The topological polar surface area is 38.9 Ų.
Is the compound canonicalized?
Yes, the compound is canonicalized.
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CAS
915945-39-0 Purity
96%
915945-39-0 Purity
96%
