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5-BROMO-1,3-DIMETHYLURACIL

5-BROMO-1,3-DIMETHYLURACIL structure

CAS No:
7033-39-8
Formula:
C6H7BrN2O2
Chemical Name:
5-BROMO-1,3-DIMETHYLURACIL
Synonyms:
SPECS AG-670/02635045;5-BROMO-1,3-DIMETHYLURACIL;1,3-Dimethyl-5-bromouracil;5-Bromo-1,3-dimethyluracil 98%;5-BROMO-1,3-DIMETHYL-1H-PYRIMIDINE-2,4-DIONE;5-broMo-1,3-diMethylpyriMidine-2,4(1H,3H)-dione;2,4(1H,3H)-Pyrimidinedione, 5-bromo-1,3-dimethyl-;5-Bromo-1,3-dimethylpyrimidine-2,4(1H,3H)-dione, 5-Bromo-1,3-dimethyl-2,4-dioxo-1,2,3,4-tetrahydropyrimidine
Categories:
Pharmaceutical Intermediates > Heterocyclic Compound

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5-BROMO-1,3-DIMETHYLURACIL Basic Attributes

Molecular Weight：

219.04

Exact Mass：

217.969086

DSSTox ID：

DTXSID70220612

HScode：

2933599090

Characteristics

PSA：

40.6

XLogP3：

0.3

Density：

1.7±0.1 g/cm3

Melting Point：

182-185 °C(lit.)

Boiling Point：

242.1°C at 760 mmHg

Flash Point：

100.2±30.1 °C

Refractive Index：

1.585

Safety Information

Transport codes：

NONH for all modes of transport

wgk germany：

hazard class code：

36/37/38

safety instructions：

26-36

Marks：

Hazard note：

Irritant

Precautionary statement(s)：

P261-P305 + P351 + P338

Hazard Statements：

H315-H319-H335

GHS Classification：

|Warning|H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]|P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501|Aggregated GHS information provided by 38 companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Drug Information

MeSH Entry Terms：

1,3-dimethyl-5-bromouracil

5-BROMO-1,3-DIMETHYLURACIL Use and Manufacturing

General procedure: A solution of bromo or chloro uracil (8.6 mmol) in dryethanol was added drop wise to an efficiently stirred solution of NaSH (20.8 mmol) in dry ethanol (50 mL) over a period of 2 h in ice cold condition. After the completion of addition, stirring was continued for an additional 4 h. Ethanol was removed under vacuum at room temperature. The residual mass was acidified with conc. HCl (25 mL). This was then extracted with CH2Cl2 (420 mL). DCM solution was washed with water (210 mL) and dried (Na2SO4). This DCM solution was directly used in the next phase-transfer catalyzed alkylation.

Computed Properties

Molecular Weight:219.04
XLogP3:0.3
Hydrogen Bond Acceptor Count:2
Exact Mass:217.96909
Monoisotopic Mass:217.96909
Topological Polar Surface Area:40.6
Heavy Atom Count:11
Complexity:249
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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5-BROMO-1,3-DIMETHYLURACIL

CAS No.: 7033-39-8

Content: 99.00%

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Guide of 5-BROMO-1,3-DIMETHYLURACIL

Basic Attributes
Characteristics
Safety Information
Drug Information
Use and Manufacturing
Computed Properties
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5-BROMO-1,3-DIMETHYLURACIL

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