Pyridoxamine dihydrochloride

Catalog Number	ACM524367
CAS Number	524-36-7
Structure
Synonyms	Pyridoxamine dihydrochloride monohydrate
IUPAC Name	4-(Aminomethyl)-5-(hydroxymethyl)-2-methylpyridin-3-ol;dihydrochloride
Molecular Weight	241.11
Molecular Formula	C8H14Cl2N2O2
Canonical SMILES	CC1=NC=C(C(=C1O)CN)CO.Cl.Cl
InChI	InChI=1S/C8H12N2O2.2ClH/c1-5-8(12)7(2-9)6(4-11)3-10-5;;/h3,11-12H,2,4,9H2,1H3;2*1H
InChI Key	HNWCOANXZNKMLR-UHFFFAOYSA-N
Boiling Point	460.1 °C/760 mmHg
Melting Point	224-226 °C(lit.)
Flash Point	232.1 °C
Purity	98%
Density	1.4025 g/cm³
Solubility	Soluble in DMSO, water, methanol
Appearance	White powder
Storage	Inert atmosphere, store in freezer, under -20 °C
Complexity	143
Covalently-Bonded Unit Count	3
Defined Atom Stereocenter Count	0
Exact Mass	240.0432331
Hazard Statements	Xi
Heavy Atom Count	14
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	5
Monoisotopic Mass	240.0432331
PhysicalState	Powder
Rotatable Bond Count	2
Topological Polar Surface Area	79.4 Ų

Custom Q&A

What is the molecular formula of pyridoxamine dihydrochloride?

The molecular formula of pyridoxamine dihydrochloride is C8H14Cl2N2O2.

What are some synonyms for pyridoxamine dihydrochloride?

Some synonyms for pyridoxamine dihydrochloride include PYRIDOXAMINE DIHYDROCHLORIDE, 4-(aminomethyl)-5-(hydroxymethyl)-2-methylpyridin-3-ol dihydrochloride, Pyridorin, and Pyridoxamine 2HCl.

What is the molecular weight of pyridoxamine dihydrochloride?

The molecular weight of pyridoxamine dihydrochloride is 241.11 g/mol.

What is the parent compound of pyridoxamine dihydrochloride?

The parent compound of pyridoxamine dihydrochloride is Pyridoxamine (CID 1052).

What are the component compounds of pyridoxamine dihydrochloride?

The component compounds of pyridoxamine dihydrochloride are Hydrochloric Acid (CID 313) and Pyridoxamine (CID 1052).

What is the IUPAC name of pyridoxamine dihydrochloride?

The IUPAC name of pyridoxamine dihydrochloride is 4-(aminomethyl)-5-(hydroxymethyl)-2-methylpyridin-3-ol;dihydrochloride.

What is the InChIKey of pyridoxamine dihydrochloride?

The InChIKey of pyridoxamine dihydrochloride is HNWCOANXZNKMLR-UHFFFAOYSA-N.

What is the CAS number of pyridoxamine dihydrochloride?

The CAS number of pyridoxamine dihydrochloride is 524-36-7.

What is the hydrogen bond donor count of pyridoxamine dihydrochloride?

The hydrogen bond donor count of pyridoxamine dihydrochloride is 5.

What is the topological polar surface area of pyridoxamine dihydrochloride?

The topological polar surface area of pyridoxamine dihydrochloride is 79.4 Å^2.

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