CAS
947534-49-8 Purity
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947534-49-8 Purity
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1-(4-Fluoro-benzyl)-1,3-dihydro-imidazol-2-one
CAS
947534-53-4
Catalog Number
ACM947534534
Category
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Specification
Synonyms
1-(4-Fluoro-benzyl)-1,3-dihydro-imidazol-2-one
What is the molecular formula of the compound with PubChem CID 44357968?
The molecular formula is C10H9FN2O.
What is the molecular weight of the compound?
The molecular weight is 192.19 g/mol.
What is the IUPAC name of the compound?
The IUPAC name is 3-[(4-fluorophenyl)methyl]-1H-imidazol-2-one.
What is the InChI of the compound?
The InChI is InChI=1S/C10H9FN2O/c11-9-3-1-8(2-4-9)7-13-6-5-12-10(13)14/h1-6H,7H2,(H,12,14).
What is the InChIKey of the compound?
The InChIKey is KIUZJUHUJXPMGA-UHFFFAOYSA-N.
What is the Canonical SMILES of the compound?
The Canonical SMILES is C1=CC(=CC=C1CN2C=CNC2=O)F.
What is the XLogP3 value of the compound?
The XLogP3 value is 0.9.
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 2 rotatable bond counts.
Is the compound canonicalized?
Yes, the compound is canonicalized.
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