| CAS Number | 1423057-36-6 |
| Catalog Number | AG00HWH4(AGN-PC-0WCX8O) |
| Chemical Name | 2-(Azetidin-3-yl)acetonitrile hydrochloride |
| IUPAC Name | 2-(azetidin-3-yl)acetonitrile;hydrochloride |
| InChI | InChI=1S/C5H8N2.ClH/c6-2-1-5-3-7-4-5;/h5,7H,1,3-4H2;1H |
| InChI Key | SJSKCHPFJJQTBK-UHFFFAOYSA-N |
| MDL Number | MFCD28501222 |
| Molecular Formula | C5H9ClN2 |
| Molecular Weight | 132.5914 |
| SMILES | N#CCC1CNC1.[H]Cl |
| Synonyms | 2-(azetidin-3-yl)acetonitrile hydrochloride,
1423057-36-6,
2-(Azetidin-3-yl)acetonitrile HCl,
SCHEMBL14697286,
MFCD28501222,
AKOS025289616,
SB11121,
KS-0000049P,
AS-52277,
CS-0052251,
F2158-1595,
Z2512942957,
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| Complexity | 95.9 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 132.045g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 8 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 132.591g/mol |
| Monoisotopic Mass | 132.045g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 35.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| 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-H332-H335
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Packing Group
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Precautionary statements
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P261-P280-P305+P351+P338
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UN Code
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Certificate of Analysis
Lot Number