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6-((4-Bromophenyl)thio)pyridin-3-amine

HCID 178786243
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Basic information

CAS
353277-60-8
Standard SMILES
Nc1ccc(Sc2ccc(Br)cc2)nc1
InChIKey
MNYGSKVEMMXWKI-UHFFFAOYSA-N
Molecular formula
C11H9BrN2S
Average molar mass
281.17 g/mol
Monoisotopic mass
279.96698

Names & identifiers

Preferred name
6-((4-Bromophenyl)thio)pyridin-3-amine
IUPAC
6-(4-bromophenyl)sulfanylpyridin-3-amine
English name
6-[(4-Bromophenyl)sulfanyl]-3-pyridinylamine
Molecular formula
C11H9BrN2S
Molecular weight
281.17

Names & synonyms

353277-60-86-((4-Bromophenyl)thio)pyridin-3-amine6-[(4-bromophenyl)sulfanyl]-3-pyridinylamine6-(4-bromophenyl)sulfanylpyridin-3-amineMFCD019279616-[(4-bromophenyl)sulfanyl]pyridin-3-amineAKOS005072254CE-0716CS-0332658AJ-333/092160223-Pyridinamine, 6-[(4-bromophenyl)thio]-

Database identifiers

CAS
353277-60-8
PubChem CID
43167516

Properties

Computed structural propertiesFilling in

XLogP
3.3
Topological polar surface area
64.2 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
3
Rotatable bonds
2
Heavy atoms
15
Formal charge
0
Complexity
195

Physicochemical properties

HazardClass
IRRITANT
HS Code
2933399990 · 2933399990

Safety & regulation

Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.

Safety data

hs_code
2933399990
hazard_class
IRRITANT

Related reactions

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Compound notes

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