2-[(4-chlorophenyl)methylsulfanyl]-3H-pyrimidin-4-one

Modify Date: 2025-09-18 20:31:23

2-[(4-chlorophenyl)methylsulfanyl]-3H-pyrimidin-4-one Structure
2-[(4-chlorophenyl)methylsulfanyl]-3H-pyrimidin-4-one structure
Common Name 2-[(4-chlorophenyl)methylsulfanyl]-3H-pyrimidin-4-one
CAS Number 91063-28-4 Molecular Weight 252.72000
Density 1.37g/cm3 Boiling Point 437.9ºC at 760 mmHg
Molecular Formula C11H9ClN2OS Melting Point N/A
MSDS N/A Flash Point 218.6ºC

 Names

Name 2-[(4-chlorophenyl)methylsulfanyl]-1H-pyrimidin-6-one
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.37g/cm3
Boiling Point 437.9ºC at 760 mmHg
Molecular Formula C11H9ClN2OS
Molecular Weight 252.72000
Flash Point 218.6ºC
Exact Mass 252.01200
PSA 71.05000
LogP 2.71560
Index of Refraction 1.658
InChIKey RVTXPYQZDUOGRG-UHFFFAOYSA-N
SMILES O=c1ccnc(SCc2ccc(Cl)cc2)[nH]1

 Synonyms

2-(4-Chlor-benzylmercapto)-3H-pyrimidin-4-on
2-(4-chloro-benzylmercapto)-3H-pyrimidin-4-one
2-[(4-chlorobenzyl)thio]pyrimidin-4-ol
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