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3-Bromo-1,5-dihydro-4H-pyrazolo[3,4-d]pyrimidin-4-one

3-Bromo-1,5-dihydro-4H-pyrazolo[3,4-d]pyrimidin-4-one structure

CAS No:
54738-73-7
Formula:
C5H3BrN4O
Chemical Name:
3-Bromo-1,5-dihydro-4H-pyrazolo[3,4-d]pyrimidin-4-one
Synonyms:
4H-Pyrazolo[3,4-d]pyrimidin-4-one,3-bromo-1,5-dihydro-;3-Bromo-1,5-dihydro-4H-pyrazolo[3,4-d]pyrimidin-4-one;3-Bromo-4-hydroxypyrazolo[3,4-d]pyrimidine;3-Bromoallopurinol;NSC 344532;3-Bromo-1H-pyrazolo[3,4-d]pyrimidin-4(5H)-one;3-Bromo-1H,4H,7H-pyrazolo[3,4-d]pyrimidin-4-one;3-Bromo-1H-pyrazolo[3,4-d]pyrimidin-4-ol;3-Bromo-1H,2H,4H-pyrazolo[3,4-d]pyrimidin-4-one;3-Bromo-1H,4H,5H-pyrazolo[3,4-d]pyrimidin-4-one;3-Bromo-2H-pyrazolo[3,4-d]pyrimidin-4-ol;3-Bromo-1,2-dihydropyrazolo[3,4-d]pyrimidin-4-one;3-Bromo-2H,4H,5H-pyrazolo[3,4-d]pyrimidin-4-one

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3-Bromo-1,5-dihydro-4H-pyrazolo[3,4-d]pyrimidin-4-one Basic Attributes

Molecular Weight：

215.01

Exact Mass：

215.01

NSC Number：

344532

DSSTox ID：

DTXSID20319383

HScode：

2933990090

Characteristics

PSA：

65.8

XLogP3：

0.3

Density：

2.2±0.1 g/cm3

Melting Point：

>300 °C

Boiling Point：

473.1°C at 760 mmHg

Flash Point：

239.9±27.3 °C

Refractive Index：

1.834

Safety Information

Precautionary statement(s)：

P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, P501

Hazard Statements：

H302

GHS Classification：

|Warning|H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]|P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501|Aggregated GHS information provided by 2 companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Computed Properties

Molecular Weight:215.01
XLogP3:0.4
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:3
Exact Mass:213.94902
Monoisotopic Mass:213.94902
Topological Polar Surface Area:70.1
Heavy Atom Count:11
Complexity:219
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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3-Bromo-1,7-dihydro-pyrazolo[3,4-d]pyrimidin-4-one

CAS No.: 54738-73-7

Content: 99.00%

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Guide of 3-Bromo-1,5-dihydro-4H-pyrazolo[3,4-d]pyrimidin-4-one

Basic Attributes
Characteristics
Safety Information
Computed Properties
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3-Bromo-1,5-dihydro-4H-pyrazolo[3,4-d]pyrimidin-4-one

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