| CAS Number | 1205750-61-3 |
| Catalog Number | AG00HFII(AGN-PC-0WAME0) |
| Chemical Name | 3-Methylpyrrolidine-3-carbonitrile, HCl |
| IUPAC Name | 3-methylpyrrolidine-3-carbonitrile;hydrochloride |
| InChI | InChI=1S/C6H10N2.ClH/c1-6(4-7)2-3-8-5-6;/h8H,2-3,5H2,1H3;1H |
| InChI Key | JCZTVYVXESIUGM-UHFFFAOYSA-N |
| MDL Number | MFCD12406579 |
| Molecular Formula | C6H11ClN2 |
| Molecular Weight | 146.6179 |
| SMILES | CC1(C#N)CNCC1.[H]Cl |
| Synonyms | 3-Cyano-3-methylpyrrolidine hydrochloride,
1205750-61-3,
3-methylpyrrolidine-3-carbonitrile hydrochloride,
3-CYANO-3-METHYLPYRROLIDINE HCL,
AK184358,
SCHEMBL2378273,
JCZTVYVXESIUGM-UHFFFAOYSA-N,
MFCD12406579,
AKOS024015508,
SB11618,
KS-000004G3,
3-Methylpyrrolidine-3-carbonitrile, HCl,
DS-10027,
AX8266648,
CS-0051238,
X-2726,
3-methylpyrrolidine-3-carbonitrile;hydrochloride,
|
| Complexity | 133 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 146.061g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 9 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 146.618g/mol |
| Monoisotopic Mass | 146.061g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 35.8A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
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