| CAS Number | 920491-09-4 |
| Catalog Number | AG00IH0F(AGN-PC-0WBT27) |
| Chemical Name | 2-Thia-6-azaspiro[3.3]heptane |
| IUPAC Name | 2-thia-6-azaspiro[3.3]heptane |
| InChI | InChI=1S/C5H9NS/c1-5(2-6-1)3-7-4-5/h6H,1-4H2 |
| InChI Key | PHMKOQSDCVHJFT-UHFFFAOYSA-N |
| MDL Number | MFCD17017542 |
| Molecular Formula | C5H9NS |
| Molecular Weight | 115.1967 |
| SMILES | C1SCC12CNC2 |
| Synonyms | 2-THIA-6-AZASPIRO[3.3]HEPTANE,
920491-09-4,
SCHEMBL364226,
PHMKOQSDCVHJFT-UHFFFAOYSA-N,
2-thia-6-azaspiro[3.3] heptane,
KS-000006IZ,
FCH925601,
MFCD17017542,
ZINC95348318,
AKOS006332735,
PB22870,
AS-51200,
SC-70251,
CS-0051790,
EN300-151683,
F2147-1027,
2-thia-6-azaspiro[3.3]heptane hemioxalate,
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| Complexity | 82.1 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 115.046g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 7 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 115.194g/mol |
| Monoisotopic Mass | 115.046g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 37.3A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.1 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number