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2-Ethoxy-5-fluoro-4(3H)-pyrimidinone

2-Ethoxy-5-fluoro-4(3H)-pyrimidinone structure

CAS No:
56177-80-1
Formula:
C6H7FN2O2
Chemical Name:
2-Ethoxy-5-fluoro-4(3H)-pyrimidinone
Synonyms:
4(3H)-Pyrimidinone,2-ethoxy-5-fluoro-;4(1H)-Pyrimidinone,2-ethoxy-5-fluoro-;2-Ethoxy-5-fluoro-4(3H)-pyrimidinone;2-Ethoxy-5-fluoropyrimidin-4-ol;2-Ethoxy-5-fluoro-3,4-dihydropyrimidin-4-one;2-Ethoxy-5-fluoro-1H-pyrimidin-6-one;2-Ethoxy-5-fluoro-1,4-dihydropyrimidin-4-one
Categories:
Pharmaceutical Intermediates > Heterocyclic Compound

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2-Ethoxy-5-fluoro-4(3H)-pyrimidinone Basic Attributes

Molecular Weight：

158.13

Exact Mass：

158.13

EC Number：

260-029-1

UNII：

15FS54053U

DSSTox ID：

DTXSID8057776

HScode：

2933599090

Characteristics

PSA：

50.7

XLogP3：

0.14

Density：

1.4±0.1 g/cm3

Melting Point：

182-183 °C @ Solvent: Ethanol

Boiling Point：

182.4±50.0 °C at 760 mmHg

Flash Point：

64.1±30.1 °C

Refractive Index：

1.529

Safety Information

Transport codes：

NONH for all modes of transport

wgk germany：

hazard class code：

36/37/38

safety instructions：

26-36-24/25

Marks：

Hazard note：

Irritant

Precautionary statement(s)：

P264, P270, P273, P301+P312, P330, P501

Hazard Statements：

H302

GHS Classification：

|Warning|H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]|P264, P270, P273, P301+P312, P330, and P501|Aggregated GHS information provided by 4 companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Computed Properties

Molecular Weight:158.13
XLogP3:0.4
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:2
Exact Mass:158.04915563
Monoisotopic Mass:158.04915563
Topological Polar Surface Area:50.7
Heavy Atom Count:11
Complexity:235
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 2-Ethoxy-5-fluoro-4(3H)-pyrimidinone

Basic Attributes
Characteristics
Safety Information
Computed Properties
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2-Ethoxy-5-fluoro-4(3H)-pyrimidinone

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