Compound C10H12BrClN2S

2-[(3-chlorophenyl)methylsulfanyl]-4,5-dihydro-1H-imidazol-1-ium bromide

CAS: 7251-54-9

Molecular Formula	`C10H12BrClN2S`
Molecular Weight	307.64 g/mol
Topological Polar Surface Area	54.3 A2
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	3
Rotatable Bonds	3
Exact Mass	305.95932
Heavy Atoms	15
Complexity	220.0

Chemical Identifiers

CAS Number	7251-54-9
SMILES	`C1CN=C([NH2+]1)SCC2=CC(=CC=C2)Cl.[Br-]`
InChIKey	`RPNXOZVDYCBJRU-UHFFFAOYSA-N`

📖 Product Overview

Compound C10H12BrClN2S (CAS: 7251-54-9) is a chemical compound with molecular formula C10H12BrClN2S and molecular weight 307.64 g/mol. Its IUPAC systematic name is 2-[(3-chlorophenyl)methylsulfanyl]-4,5-dihydro-1H-imidazol-1-ium bromide. Topological Polar Surface Area 54.3 A2 Hydrogen Bond Donors 1 Hydrogen Bond Acceptors 3 Rotatable Bonds 3 Exact Mass 305.95932 Heavy Atoms 15 Complexity 220.0 InChI Key: RPNXOZVDYCBJRU-UHFFFAOYSA-N. SMILES: C1CN=C([NH2+]1)SCC2=CC(=CC=C2)Cl.[Br-].

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