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Structure

5-Bromo-2-methylsulfanyl-3H-pyrimidin-4-one

CAS
81560-03-4
Catalog Number
ACM81560034
Category
Other Products
Molecular Weight
221.075
Molecular Formula
C5H5BrN2OS

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Specification

Synonyms
NSC46962, MolPort-001-835-886, MolPort-002-800-265, CID240565, B5029G1, 5-bromo-2-(methylsulfanyl)-4(1H)-pyrimidinone, AE-534/30057046, 81560-03-4
IUPAC Name
5-bromo-2-methylsulfanyl-1H-pyrimidin-6-one
Canonical SMILES
CSC1=NC=C(C(=O)N1)Br
InChI Key
BKWWYXOEVKZFDA-UHFFFAOYSA-N
Boiling Point
280.4ºC at 760mmHg
Flash Point
123.4ºC
Density
1.88g/cm³
Exact Mass
219.93100
H-Bond Acceptor
2
H-Bond Donor
1
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