| CAS Number | 1706418-86-1 |
| Catalog Number | AG00J2AG |
| Chemical Name | 3-(hydroxymethyl)piperidin-3-ol hydrochloride |
| IUPAC Name | 3-(hydroxymethyl)piperidin-3-ol;hydrochloride |
| InChI | InChI=1S/C6H13NO2.ClH/c8-5-6(9)2-1-3-7-4-6;/h7-9H,1-5H2;1H |
| InChI Key | GKEFJIRFUVVIOL-UHFFFAOYSA-N |
| MDL Number | MFCD23105868 |
| Molecular Formula | C6H14ClNO2 |
| Molecular Weight | 167.6339 |
| SMILES | C1(CCCNC1)(CO)O.Cl |
| Synonyms | 3-(hydroxymethyl)piperidin-3-ol hydrochloride,
1706418-86-1,
3-(Hydroxymethyl)-3-piperidinol hydrochloride,
3-Hydroxymethyl-3-hydroxypiperidine hydrochloride,
3-hydroxymethyl-3-hydroxypiperidine,
MFCD23105868,
AKOS027327507,
PB39138,
SB20401,
3-hydroxymethyl-3-hydroxypiperidine hcl,
AS-34585,
Z2284393168,
(1,5-dimethyl-1H-benzimidazol-2-yl)methanol,
848069-91-0,
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| Complexity | 97.1 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 167.071g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 4 |
| Isotope Atom Count | 0 |
| Molecular Weight | 167.633g/mol |
| Monoisotopic Mass | 167.071g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 52.5A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number