CAS
942206-35-1 Purity
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942206-35-1 Purity
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2H-Pyrrol-2-one, 4-acetyl-1-(4-chloro-2-fluorophenyl)-5-cyclohexyl-1,5-dihydro-3-hydroxy-, (5S)-
CAS
942222-78-8
Catalog Number
ACM942222788
Category
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Specification
Synonyms
2H-Pyrrol-2-one, 4-acetyl-1-(4-chloro-2-fluorophenyl)-5-cyclohexyl-1,5-dihydro-3-hydroxy-, (5S)-
What is the molecular formula of the compound with PubChem CID 73013747?
The molecular formula is C18H19ClFNO3.
What is the molecular weight of the compound?
The molecular weight is 351.8 g/mol.
What are some synonyms for the compound?
2H-Pyrrol-2-one, 4-acetyl-1-(4-chloro-2-fluorophenyl)-5-cyclohexyl-1,5-dihydro-3-hydroxy-, (5S)- and 942222-78-8 (s)-4-acetyl-1-(4-chloro-2-fluorophenyl)-5-cyclohexyl-3-hydroxy-1,5-dihydro-2h-pyrrol-2-one.
What is the IUPAC name of the compound?
(2S)-3-acetyl-1-(4-chloro-2-fluorophenyl)-2-cyclohexyl-4-hydroxy-2H-pyrrol-5-one.
What is the InChI of the compound?
InChI=1S/C18H19ClFNO3/c1-10(22)15-16(11-5-3-2-4-6-11)21(18(24)17(15)23)14-8-7-12(19)9-13(14)20/h7-9,11,16,23H,2-6H2,1H3/t16-/m0/s1.
What is the InChIKey of the compound?
VQNLJXWZGVRLBA-INIZCTEOSA-N.
How many hydrogen bond donor counts does the compound have?
The compound has 1 hydrogen bond donor count.
How many rotatable bond counts does the compound have?
The compound has 3 rotatable bond counts.
What is the topological polar surface area of the compound?
The topological polar surface area is 57.6 2.
Is the compound canonicalized?
Yes, the compound is canonicalized.
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CAS
942206-37-3 Purity
96%
942206-37-3 Purity
96%
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