| CAS Number | 1107658-76-3 |
| Catalog Number | AG00ILBO(AGN-PC-0WNGWH) |
| Chemical Name | (3R,5S)-5-Methylpyrrolidin-3-ol hydrochloride |
| IUPAC Name | (3R,5S)-5-methylpyrrolidin-3-ol;hydrochloride |
| InChI | InChI=1S/C5H11NO.ClH/c1-4-2-5(7)3-6-4;/h4-7H,2-3H2,1H3;1H/t4-,5+;/m0./s1 |
| InChI Key | YPSDRILWPNPXQJ-UYXJWNHNSA-N |
| MDL Number | MFCD29920525 |
| Molecular Formula | C5H12ClNO |
| Molecular Weight | 137.6079 |
| SMILES | Cl.C[C@H]1C[C@@H](O)CN1 |
| Synonyms | (3R,5S)-5-Methylpyrrolidin-3-ol hydrochloride,
1107658-76-3,
(3R,5S)-5-Methylpyrrolidin-3-ol HCl,
SCHEMBL2201785,
KS-000006CB,
MFCD29920525,
SB22154,
AS-47264,
CS-0053292,
|
| Complexity | 65.1 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 2 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 137.061g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 8 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 3 |
| Isotope Atom Count | 0 |
| Molecular Weight | 137.607g/mol |
| Monoisotopic Mass | 137.061g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 32.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
| Symbol: |  |
|
Hazard Class
|
\N
|
|
Hazard statements
|
H302-H315-H319-H335
|
|
Packing Group
|
\N
|
|
Precautionary statements
|
P261-P305+P351+P338
|
|
UN Code
|
\N
|
Certificate of Analysis
Lot Number