Heptaminol hydrochlorideProduct ingredient for Heptaminol
- Name
- Heptaminol hydrochloride
- Drug Entry
- Heptaminol
- Accession Number
- DBSALT003067
- Structure
Structure for Heptaminol hydrochloride (DBSALT003067)
- Synonyms
- Heptaminol HCl / Heptamyl HCl / Heptamyl hydrochloride
- External IDs
- 208-837-5 / 2831RP / RP 2831 / RP-2831
- UNII
- XB3RM40HIR
- CAS Number
- 543-15-7
- Weight
- Average: 181.7
Monoisotopic: 181.123342 - Chemical Formula
- C8H20ClNO
- InChI Key
- JZNBMCOSOXIZJB-UHFFFAOYSA-N
- InChI
- InChI=1S/C8H19NO.ClH/c1-7(9)5-4-6-8(2,3)10;/h7,10H,4-6,9H2,1-3H3;1H
- IUPAC Name
- 6-amino-2-methylheptan-2-ol hydrochloride
- SMILES
- Cl.CC(N)CCCC(C)(C)O
- External Links
- ChemSpider
- 10504
- ChEMBL
- CHEMBL2107282
- Predicted Properties
Property Value Source Water Solubility 16.2 mg/mL ALOGPS logP 1.31 ALOGPS logP 0.82 Chemaxon logS -0.95 ALOGPS pKa (Strongest Acidic) 18.53 Chemaxon pKa (Strongest Basic) 10.43 Chemaxon Physiological Charge 1 Chemaxon Hydrogen Acceptor Count 2 Chemaxon Hydrogen Donor Count 2 Chemaxon Polar Surface Area 46.25 Å2 Chemaxon Rotatable Bond Count 4 Chemaxon Refractivity 43.8 m3·mol-1 Chemaxon Polarizability 18.22 Å3 Chemaxon Number of Rings 0 Chemaxon Bioavailability 1 Chemaxon Rule of Five Yes Chemaxon Ghose Filter Yes Chemaxon Veber's Rule No Chemaxon MDDR-like Rule No Chemaxon