| CAS Number | 1106941-26-7 |
| Catalog Number | AG00HBRC(AGN-PC-040QEZ) |
| Chemical Name | 3-(2-Methoxyphenyl)pyrrolidine hydrochloride |
| IUPAC Name | 3-(2-methoxyphenyl)pyrrolidine;hydrochloride |
| InChI | InChI=1S/C11H15NO.ClH/c1-13-11-5-3-2-4-10(11)9-6-7-12-8-9;/h2-5,9,12H,6-8H2,1H3;1H |
| InChI Key | KMJQMZFKHUFNIL-UHFFFAOYSA-N |
| MDL Number | MFCD03701258 |
| Molecular Formula | C11H16ClNO |
| Molecular Weight | 213.7038 |
| SMILES | COC1=CC=CC=C1C2CNCC2.[H]Cl |
| Synonyms | 3-(2-Methoxyphenyl)pyrrolidine hydrochloride,
1106941-26-7,
3-(2-methoxyphenyl)pyrrolidine HCl,
3-(2-Methoxyphenyl)pyrrolidinehydrochloride,
SCHEMBL568047,
DTXSID80632580,
KMJQMZFKHUFNIL-UHFFFAOYSA-N,
MFCD03701258,
AKOS016010957,
DS-6130,
MCULE-1108680191,
NE50965,
AK119890,
EN300-82404,
3-(2-Methoxy-phenyl)-pyrrolidine hydrochloride,
Z1250132363,
3-(2-Methoxyphenyl)pyrrolidine--hydrogen chloride (1/1),
91246-24-1,
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| Complexity | 160 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 213.092g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 213.705g/mol |
| Monoisotopic Mass | 213.092g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 21.3A^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