2-amino-7-methyl-5H-(1,3,4)thiadiazolo(3,2-a)pyrimidin-5-one
Completing data — refresh the page later to see the latest
Basic information
- CAS
31737-02-7- Standard SMILES
Cc1cc(=O)n2nc(N)sc2n1- InChIKey
BUKDQMJGUPDVST-UHFFFAOYSA-N- Molecular formula
- C6H6N4OS
- Average molar mass
- 182.21 g/mol
- Monoisotopic mass
- 182.026232
Names & identifiers
- Preferred name
- 2-amino-7-methyl-5H-(1,3,4)thiadiazolo(3,2-a)pyrimidin-5-one
- IUPAC
- 2-amino-7-methyl-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
- English name
- 2-AMINO-7-METHYL-[1,3,4]THIADIAZOLO[3,2-A]PYRIMIDIN-5-ONE
- Molecular formula
- C6H6N4OS
- Molecular weight
- 182.2
Names & synonyms
2-amino-7-methyl-5h-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one2-amino-7-methyl-5H-(1,3,4)thiadiazolo(3,2-a)pyrimidin-5-oneRefChem:464853999-540-631737-02-72-Amino-7-methyl-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-oneMFCD004666232-amino-7-methyl-4-hydro-1,3,4-thiadiazolino[3,2-a]pyrimidin-5-oneOprea1_330916DTXSID90351472HMS1684I125H-1,3,4-Thiadiazolo[3,2-a]pyrimidin-5-one,2-amino-7-methyl-
Show more names
5H-1,3,4-Thiadiazolo[3,2-a]pyrimidin-5-one, 2-amino-7-methyl-
GBA73702SBB001683STK761217AKOS000670362ST057650SY132697CS-0078642EU-0052291
Database identifiers
- CAS
31737-02-7- PubChem CID
- 700998
- DTXSID
DTXSID90351472- EC Number
- 999-540-6
- Nikkaji
- J702.741I
Properties
Computed structural propertiesFilling in
- XLogP
- 0
- Topological polar surface area
- 96.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 0
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 343
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%)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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