Tert-butyl [5-(methoxymethyl)-1,3,4-thiadiazol-2-yl]carbamate
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Basic information
- Standard SMILES
COCc1nnc(NC(=O)OC(C)(C)C)s1- InChIKey
VRUPZTRZYPZPPX-UHFFFAOYSA-N- Molecular formula
- C9H15N3O3S
- Average molar mass
- 245.3 g/mol
- Monoisotopic mass
- 245.08341252
Names & identifiers
- Preferred name
- Tert-butyl [5-(methoxymethyl)-1,3,4-thiadiazol-2-yl]carbamate
- IUPAC
- tert-butyl N-[5-(methoxymethyl)-1,3,4-thiadiazol-2-yl]carbamate
Names & synonyms
tert-butyl [5-(methoxymethyl)-1,3,4-thiadiazol-2-yl]carbamate1294001-20-9SCHEMBL27879248VRUPZTRZYPZPPX-UHFFFAOYSA-NDB-335528
Database identifiers
- PubChem CID
- 84382575
Properties
Computed structural propertiesFilling in
- XLogP
- 1
- Topological polar surface area
- 102 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 5
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 245
Related reactions
2 records
Compound notes
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