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5580-94-9

5580-94-9 structure

5580-94-9 structure

Name: 4-amino-5-bromo-1-(oxan-2-yl)pyrimidin-2-one
Chemical Name: 4-amino-5-bromo-1-(oxan-2-yl)pyrimidin-2-one
CAS Number: 5580-94-9
Molecular Formula: C₉H₁₂BrN₃O₂
Molecular Weight: 274.11400
Create Date: 2017-01-12 10:56:54
Modify Date: 2025-08-25 12:29:50

Name	4-amino-5-bromo-1-(oxan-2-yl)pyrimidin-2-one
Synonyms	4-amino-5-bromo-1-tetrahydropyran-2-yl-1H-pyrimidin-2-one

Density	1.83g/cm3
Boiling Point	380.5ºC at 760 mmHg
Molecular Formula	C₉H₁₂BrN₃O₂
Molecular Weight	274.11400
Flash Point	183.9ºC
Exact Mass	273.01100
PSA	70.14000
LogP	1.86830
Index of Refraction	1.7

CHEMICAL IDENTIFICATION

RTECS NUMBER :: HA6000000

CHEMICAL NAME :: Cytosine, 5-bromo-1-(tetrahydropyran-2-yl)-

CAS REGISTRY NUMBER :: 5580-94-9

BEILSTEIN REFERENCE NO. :: 1577609

LAST UPDATED :: 199612

DATA ITEMS CITED :: 1

MOLECULAR FORMULA :: C9-H12-Br-N3-O2

MOLECULAR WEIGHT :: 274.15

WISWESSER LINE NOTATION :: T6OTJ B- AT6NVNJ DZ EE

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :: LD50 - Lethal dose, 50 percent kill

ROUTE OF EXPOSURE :: Intravenous

SPECIES OBSERVED :: Rodent - mouse

DOSE/DURATION :: 180 mg/kg

TOXIC EFFECTS :: Details of toxic effects not reported other than lethal dose value

REFERENCE :: CSLNX* U.S. Army Armament Research & Development Command, Chemical Systems Laboratory, NIOSH Exchange Chemicals. (Aberdeen Proving Ground, MD 21010) Volume(issue)/page/year: NX#06979

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