| CAS Number | 1433176-83-0 |
| Catalog Number | AG00HWUS(AGN-PC-0WD73M) |
| Chemical Name | 2-methanesulfonyl-2,6-diazaspiro[3.3]heptane |
| IUPAC Name | 2-methylsulfonyl-2,6-diazaspiro[3.3]heptane |
| InChI | InChI=1S/C6H12N2O2S/c1-11(9,10)8-4-6(5-8)2-7-3-6/h7H,2-5H2,1H3 |
| InChI Key | BEMZHSZVNONKAW-UHFFFAOYSA-N |
| MDL Number | MFCD26381274 |
| Molecular Formula | C6H12N2O2S |
| Molecular Weight | 176.2367 |
| SMILES | CS(N1CC2(CNC2)C1)(=O)=O |
| Synonyms | 2-Methanesulfonyl-2,6-diazaspiro[3.3]heptane,
1433176-83-0,
2-(Methylsulfonyl)-2,6-diazaspiro[3.3]heptane,
2,6-Diazaspiro[3.3]heptane, 2-(methylsulfonyl)-,
SCHEMBL14919592,
KS-000005ZE,
MFCD26381274,
ZINC96509193,
SB15861,
AS-51980,
CS-0051892,
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| Complexity | 255 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 176.062g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 176.234g/mol |
| Monoisotopic Mass | 176.062g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 57.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | -1.3 |
GHS Hazard and Precautionary Statements
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Hazard Class
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Hazard statements
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H302-H315-H319-H335
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Packing Group
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Precautionary statements
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P261-P305+P351+P338
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UN Code
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Certificate of Analysis
Lot Number