| CAS Number | 115182-91-7 |
| Catalog Number | AG000GED(AGN-PC-00L5R5) |
| Chemical Name | 2-CYANO-3-AZABICYCLO[3.1.0]HEXANE |
| IUPAC Name | 3-azabicyclo[3.1.0]hexane-2-carbonitrile |
| InChI | InChI=1S/C6H8N2/c7-2-6-5-1-4(5)3-8-6/h4-6,8H,1,3H2 |
| InChI Key | JFUYLMCSIHJLOX-UHFFFAOYSA-N |
| MDL Number | MFCD19218073 |
| Molecular Formula | C6H8N2 |
| Molecular Weight | 108.1411 |
| SMILES | N#CC1C2CC2CN1 |
| Synonyms | 115182-91-7,
2-CYANO-3-AZABICYCLO[3.1.0]HEXANE,
3-AZABICYCLO[3.1.0]HEXANE-2-CARBONITRILE,
SCHEMBL9178943,
KS-000006UF,
FCH952606,
MFCD19218073,
AKOS006358674,
PB19689,
AK172160,
AS-34397,
ST1080446,
CS-0051919,
Q-3151,
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| Complexity | 155 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 108.069g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 8 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 108.144g/mol |
| Monoisotopic Mass | 108.069g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 35.8A^2 |
| Undefined Atom Stereocenter Count | 3 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0 |
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Certificate of Analysis
Lot Number