2-Methanesulfonylpyrimidin-5-amine
Basic information
- CAS
56621-92-2- Standard SMILES
CS(=O)(=O)c1ncc(N)cn1- InChIKey
ZELVQVPQIRFOQU-UHFFFAOYSA-N- Molecular formula
- C5H7N3O2S
- Average molar mass
- 173.2 g/mol
- Monoisotopic mass
- 173.02589765
Names & identifiers
- Preferred name
- 2-Methanesulfonylpyrimidin-5-amine
- IUPAC
- 2-methylsulfonylpyrimidin-5-amine
- English name
- 2-(Methylsulfonyl)pyrimidin-5-amine
- Molecular formula
- C5H7N3O2S
- Molecular weight
- 173.19
Names & synonyms
2-methanesulfonylpyrimidin-5-amineRefChem:474108964-978-92-(METHYLSULFONYL)PYRIMIDIN-5-AMINE56621-92-22-methylsulfonylpyrimidin-5-amineMFCD082348795-Amino-2-methylsulfonylpyrimidineSCHEMBL3210214DTXSID003384515-AMINO-2-MESYLPYRIMIDINEZELVQVPQIRFOQU-UHFFFAOYSA-N
Show more names
5-Pyrimidinamine, 2-(methylsulfonyl)-
GCA621922-(Methanesulfonyl)pyrimidin-5-amineAKOS0103897062-(Methylsulfonyl)-5-pyrimidinamine #AS-62160CS-0244917C75658EN300-2966575
Database identifiers
- CAS
56621-92-2- PubChem CID
- 549170
- DTXSID
DTXSID00338451- EC Number
- 964-978-9
- Nikkaji
- J46.766I
Properties
Computed structural properties
- XLogP
- -0.9
- Topological polar surface area
- 94.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 1
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 212
Physicochemical properties
- storage temp.
- Keep in dark place,Inert atmosphere,Room temperature
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H332-H335
- Precautionary statements
- 261 · P261-P280-P305+P351+P338
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
Warning
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesAcute Tox. 4 (100%)
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H332-H335
- Precautionary statements
- P261-P280-P305+P351+P338
Suppliers
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Related reactions
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Compound notes
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