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Benzenemethanamine, 2-((3-bromophenyl)thio)-N,N-dimethyl-, hydrochloride

HCID 3071802
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Basic information

CAS
139009-36-2
Standard SMILES
CN(C)Cc1ccccc1Sc1cccc(Br)c1.Cl
InChIKey
RCHMSNAOUWDHQI-UHFFFAOYSA-N
Molecular formula
C15H17BrClNS
Average molar mass
358.7 g/mol
Monoisotopic mass
356.99536

Names & identifiers

Preferred name
Benzenemethanamine, 2-((3-bromophenyl)thio)-N,N-dimethyl-, hydrochloride
IUPAC
1-[2-(3-bromophenyl)sulfanylphenyl]-N,N-dimethylmethanamine;hydrochloride
English name
Benzenemethanamine, 2-((3-bromophenyl)thio)-N,N-dimethyl-, hydrochloride
Molecular formula
C15H17BrClNS
Molecular weight
358.72

Names & synonyms

VUFB 17666Benzenemethanamine, 2-((3-bromophenyl)thio)-N,N-dimethyl-, hydrochlorideN,N-Dimethyl-2-(3-bromophenylthio)benzylamine hydrochloride139009-36-2Benzylamine, o-((m-bromophenyl)thio)-N,N-dimethyl-, hydrochloride2-((3-Bromophenyl)thio)-N,N-dimethylbenzenemethanamine hydrochlorideDTXSID90160869RefChem:324713DTXCID7083360AKOS024426333(2-((3-BROMOPHENYL)THIO)PHENYL)-N,N-DIMETHYLMETHANAMINE HYDROCHLORIDE1-{2-[(3-Bromophenyl)sulfanyl]phenyl}-N,N-dimethylmethanamine--hydrogen chloride (1/1)

Database identifiers

CAS
139009-36-2
PubChem CID
3071802
DTXSID
DTXSID90160869

Properties

Computed structural properties

Topological polar surface area
28.5 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
2
Rotatable bonds
4
Heavy atoms
19
Formal charge
0
Complexity
247

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