CAS
4224-70-8 Purity
>96.0%(GC)(T)
4224-70-8 Purity
>96.0%(GC)(T)
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2-(Bromomethyl)-4-phenylthiazole
CAS
78502-79-1
Catalog Number
ACM78502791
Category
Bromine Series
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- Synthetic Use
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What is the molecular formula of the compound?
The molecular formula is C10H8BrNS.
What is the molecular weight of the compound?
The molecular weight is 254.15 g/mol.
What is the IUPAC name of the compound?
The IUPAC name is 2-(bromomethyl)-4-phenyl-1,3-thiazole.
What is the InChI of the compound?
The InChI is InChI=1S/C10H8BrNS/c11-6-10-12-9(7-13-10)8-4-2-1-3-5-8/h1-5,7H,6H2.
What is the InChIKey of the compound?
The InChIKey is MYRGZTAFPPWJGI-UHFFFAOYSA-N.
What is the canonical SMILES of the compound?
The canonical SMILES is C1=CC=C(C=C1)C2=CSC(=N2)CBr.
How many hydrogen bond donor counts does the compound have?
The compound has 0 hydrogen bond donor counts.
How many hydrogen bond acceptor counts does the compound have?
The compound has 2 hydrogen bond acceptor counts.
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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