Basic Information | Post buying leads | Suppliers |
Name |
2,6-Pyridinedimethanol hydrochloride |
EINECS | N/A |
CAS No. | 21197-76-2 | Density | N/A |
PSA | 53.35000 | LogP | 0.86820 |
Solubility | N/A | Melting Point |
153-160℃ |
Formula | C7H10ClNO2 | Boiling Point | N/A |
Molecular Weight | 175.61 | Flash Point | N/A |
Transport Information | N/A | Appearance | N/A |
Safety | Risk Codes | N/A | |
Molecular Structure | Hazard Symbols | N/A | |
Synonyms |
2,6-Pyridinedimethanol,hydrochloride (8CI,9CI);[6-(Hydroxymethyl)pyridin-2-yl]methanol hydrochloride;[6-(Hydroxymethyl)-2-pyridyl]methanol hydrochloride;2,6-Bis(hydroxymethyl)pyridine hydrochloride; |
The 2,6-Pyridinedimethanol,hydrochloride (1:1), with the CAS registry number 21197-76-2, is also known as 2,6-Bis(hydroxymethyl)pyridine hydrochloride. This chemical's molecular formula is C7H10ClNO2 and molecular weight is 175.61. What's more, its IUPAC name is [6-(hydroxymethyl)pyridin-2-yl]methanol hydrochloride.
Computational chemistry data of 2,6-Pyridinedimethanol,hydrochloride (1:1) are: (1)H-Bond Donor: 3; (2)H-Bond Acceptor: 3; (3)Rotatable Bond Count: 2; (4)Exact Mass: 175.040006; (5)MonoIsotopic Mass: 175.040006; (6)Topological Polar Surface Area: 53.4; (7)Heavy Atom Count: 11; (8)Formal Charge: 0; (9)Complexity: 87.6; (10)Isotope Atom Count: 0; (11)Defined Bond StereoCenter Count: 0; (12)Undefined Bond StereoCenter Count: 0; (13)Covalently-Bonded Unit Count: 2.
You can still convert the following datas into molecular structure:
(1)Canonical SMILES: C1=CC(=NC(=C1)CO)CO.Cl
(2)InChI: InChI=1S/C7H9NO2.ClH/c9-4-6-2-1-3-7(5-10)8-6;/h1-3,9-10H,4-5H2;1H
(3)InChIKey: VSICEQUMRIDAGS-UHFFFAOYSA-N