| CAS Number | 31788-96-2 |
| Catalog Number | AG00D0C8(AGN-PC-0R73UO) |
| Chemical Name | 2-Phenyl-2-pyrrolidinylethylamine DiHCl |
| IUPAC Name | 2-phenyl-2-pyrrolidin-1-ylethanamine;dihydrochloride |
| InChI | InChI=1S/C12H18N2.2ClH/c13-10-12(14-8-4-5-9-14)11-6-2-1-3-7-11;;/h1-3,6-7,12H,4-5,8-10,13H2;2*1H |
| InChI Key | HXIUHWWUUPRKDB-UHFFFAOYSA-N |
| MDL Number | MFCD08445576 |
| Molecular Formula | C12H20Cl2N2 |
| Molecular Weight | 263.2066 |
| SMILES | Cl.Cl.NCC(N1CCCC1)C1=CC=CC=C1 |
| Synonyms | 31788-96-2,
2-PHENYL-2-PYRROLIDINYLETHYLAMINE 2HCL,
2-Phenyl-2-pyrrolidinylethylamine dihydrochloride,
SCHEMBL3600790,
2-Phenyl-2-(pyrrolidin-1-yl)ethylamine dihydrochloride,
CTK7E2862,
DBA-0-1,
DTXSID20590054,
ZX-AT001189,
5103AH,
AR3482,
OR12694,
2-Phenyl-2-pyrrolidinylethylamine DiHCl,
AS-45620,
X-3312,
2-Phenyl-2-(pyrrolidin-1-yl)ethan-1-amine--hydrogen chloride (1/2),
C12H18N2.2HCl,
|
| Complexity | 158 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 3 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 262.1g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 16 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 3 |
| Isotope Atom Count | 0 |
| Molecular Weight | 263.206g/mol |
| Monoisotopic Mass | 262.1g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 29.3A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number