Basic information
- CAS
389630-98-2- Standard SMILES
NCc1nncs1- InChIKey
MGOALIGCJKNQBC-UHFFFAOYSA-N- Molecular formula
- C3H5N3S
- Average molar mass
- 115.16 g/mol
- Monoisotopic mass
- 115.02041835
Names & identifiers
- Preferred name
- (1,3,4-Thiadiazol-2-yl)methanamine
- IUPAC
- 1,3,4-thiadiazol-2-ylmethanamine
- English name
- 1,3,4-THIADIAZOL-2-YLMETHYLAMINE,97%
- Molecular formula
- C3H5N3S
- Molecular weight
- 115.16
Names & synonyms
389630-98-2(1,3,4-thiadiazol-2-yl)methanamine1,3,4-thiadiazol-2-ylmethanamine1,3,4-THIADIAZOL-2-YLMETHYLAMINE1-(1,3,4-Thiadiazol-2-yl)methanamine1,3,4-Thiadiazole-2-methanamineSCHEMBL4457345SCHEMBL8631536SCHEMBL9572728DTXSID00618725AKOS006282729PB21876
Show more names
1,3,4-Thiadiazole-2-methylamine1,3,4-THIADIAZOL-2-YLMETHYLAMINE,97%1,3,4-THIADIAZOL-2-YLMETHYLAMINE HCl
DB-345507EN300-344810
Database identifiers
- CAS
389630-98-2- PubChem CID
- 21843659
- DTXSID
DTXSID00618725- Nikkaji
- J646.311H
Properties
Computed structural properties
- XLogP
- -0.7
- Topological polar surface area
- 80 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 1
- Heavy atoms
- 7
- Formal charge
- 0
- Complexity
- 58.1
Physicochemical properties
- Boiling point
- 236.6 · 236.6±42.0 °C(Predicted)
- Density
- 1.349 · 1.349±0.06 g/cm3(Predicted)
- pka
- 6.63 · 6.63±0.29(Predicted)
Chemistry & industry
Suppliers7 total
上海伯韵医药科技有限公司13817873692 · [email protected]
上海贺康生物技术有限公司17721021104 18939837085 · [email protected]
深圳市创鑫生物科技有限公司13417589054 · [email protected]
上海相辉医药科技有限公司[email protected]
Capot Chemical Co.,Ltd.+86-（0）57185586718 +86-13336195806 · [email protected]
上海相辉医药科技有限公司13611835272 13611835272 · [email protected]
合肥钼凯医药科技有限公司18001872185; 18001872185 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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