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5-methoxy-2-methylsulfonyl-1H-pyrimidin-6-one

5-methoxy-2-methylsulfonyl-1H-pyrimidin-6-one structure

CAS No:
13906-36-0
Formula:
C6H8N2O4S
Chemical Name:
5-methoxy-2-methylsulfonyl-1H-pyrimidin-6-one
Synonyms:
13906-36-0;5-methoxy-2-(methylsulfonyl)pyrimidin-4(3h)-one;NSC55981;5-methoxy-2-methylsulfonyl-1H-pyrimidin-6-one;SCHEMBL1442774;SCHEMBL9360855;DTXSID70288479;NSC-55981;ZINC17314585;AKOS024330886;MCULE-1536296532;5-methoxy-2-(methylsulfonyl)-4-pyrimidinol;5-Methoxy-2-(methylsulfonyl)pyrimidin-4-ol

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5-methoxy-2-methylsulfonyl-1H-pyrimidin-6-one Basic Attributes

Molecular Weight：

204.21 g/mol

Exact Mass：

204.02047791 g/mol

NSC Number：

55981

DSSTox ID：

DTXSID70288479

Characteristics

PSA：

93.2 Å²

Safety Information

GHS Classification：

|Warning|H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]|P264, P270, P301+P312, P330, and P501|Aggregated GHS information provided by 38 companies from 1 notifications to the ECHA C&L Inventory.

Computed Properties

Molecular Weight:204.21
XLogP3:-0.9
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:2
Exact Mass:204.02047791
Monoisotopic Mass:204.02047791
Topological Polar Surface Area:93.2
Heavy Atom Count:13
Complexity:387
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 5-methoxy-2-methylsulfonyl-1H-pyrimidin-6-one

Basic Attributes
Characteristics
Safety Information
Computed Properties

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