C12H14BrNOS.ClH structure

C12H14BrNOS.ClH

2-[(3-bromophenyl)methylsulfanyl]-4,4-dimethyl-5H-1,3-oxazole;hydrochloride

Also Known As: ACMC-20m36o|Oxazole, 4,5-dihydro-2-(((3-bromophenyl)methyl)thio)-4,4-dimethyl-, hydrochloride|2-(3-Bromobenzylthio)-4,4-dimethyl-2-oxazoline hydrochloride|2-[(3-bromophenyl)methylsulfanyl]-4,4-dimethyl-5H-1,3-oxazole hydrochloride|4,5-Dihydro-2-(((3-bromophenyl)methyl)thio)-4,4-dimethyloxazole hydrochloride|2-[(3-bromophenyl)methylsulfanyl]-4,4-dimethyl-5H-1,3-oxazole;hydrochloride|2-((3-bromophenyl)methylsulfanyl)-4,4-dimethyl-5h-1,3-oxazole hcl|Oxazole,2-[[(3-bromophenyl)methyl]thio]-4,5-dihydro-4,4-dimethyl-, hydrochloride (1:1)|2-((3-Bromobenzyl)thio)-4,4-dimethyl-4,5-dihydrooxazole hydrochloride|2-[(3-bromophenyl)methylsulfanyl]-4,4-dimethyl-5H-1,3-oxazole,hydrochloride|Oxazole,2-[[(3-bromophenyl)methyl]thio]-4,5-dihydro-4,4-dimethyl-,hydrochloride (1:1)|2-{[(3-Bromophenyl)methyl]sulfanyl}-4,4-dimethyl-4,5-dihydro-1,3-oxazole--hydrogen chloride (1/1)

CAS: 100098-72-4
Molecular Formula C12H15BrClNOS
Molecular Weight 334.97464 g/mol
LogP 4.2689
Topological Polar Surface Area 21.59 Ų
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 3
Rotatable Bonds 2
Exact Mass 334.97464
Monoisotopic Mass 334.97464
Heavy Atoms 17
Complexity 422.7216

Chemical Identifiers

CAS Number 100098-72-4
SMILES CC1(COC(=N1)SCC2=CC(=CC=C2)Br)C.Cl

Product Overview

C12H14BrNOS.ClH (CAS 100098-72-4), with molecular formula C12H15BrClNOS and molecular weight 334.97464 g/mol. IUPAC: 2-[(3-bromophenyl)methylsulfanyl]-4,4-dimethyl-5H-1,3-oxazole;hydrochloride.

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