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ibandronic acid

CAS 114084-78-5C9H23NO7P2MW 319.23

ibandronic acid (CAS 114084-78-5) — formula C9H23NO7P2, molecular weight 319.23; category organic chemicals.

Product Overview

CAS Number114084-78-5
Molecular FormulaC9H23NO7P2
Molecular Weight319.23
Melting Point113-115
LogP-2.1
CategoryOrganic Chemicals

Technical Profile

What this product is

ibandronic acid is a carbon-based organic compound with CAS registry number 114084-78-5 and molecular formula C9H23NO7P2 (molecular weight 319.23), belonging to the organic chemicals segment of chemical raw materials.

Identification

CAS number: 114084-78-5

Its molecular formula C9H23NO7P2 comprises 9 C, 23 H, 1 N, 7 O, 2 P atoms.

Also known as: ibandronic acid · 伊班膦酸

Category: organic chemicals

Frequently Asked Questions

What is the CAS number of ibandronic acid?

The CAS registry number of ibandronic acid is 114084-78-5.

What is the molecular formula and molecular weight of ibandronic acid?

Molecular formula C9H23NO7P2, molecular weight 319.23.

What other names is ibandronic acid known by?

It is also registered under: ibandronic acid, 伊班膦酸.

Which category does ibandronic acid belong to?

Category: Organic Chemicals.

PubChem Public Data

Independent reference data for ibandronic acid (CAS 114084-78-5), compiled from public chemistry databases.

Registry identifiers across databases

CAS Registry Number114084-78-5
PubChem CID60852
Molecular formulaC9H23NO7P2
IUPAC name[1-hydroxy-3-[methyl(pentyl)amino]-1-phosphonopropyl]phosphonic acid
UNII (FDA)UMD7G2653W

Computed descriptors

Molecular Weight319.23
XLogP3-4.1
Hydrogen Bond Donor Count5
Hydrogen Bond Acceptor Count8
Rotatable Bond Count9
Exact Mass319.09497607
Monoisotopic Mass319.09497607
Topological Polar Surface Area139
Heavy Atom Count19

Physicochemical values on record

Melting Point113-115
Solubility1.34e+01 g/L
LogP-2.1

Documented uses on record

    Use (kg; approx.) in Germany (2009): >100Consumption (g per capita; approx.) in Germany (2009): 0.00122

    Synonyms and trade names

    Ibandronic Acid; Ibandronate; 114084-78-5; Bondenza; Iasibon; {1-hydroxy-3-[methyl(pentyl)amino]-1-phosphonopropyl}phosphonic acid; Ibandronic Acid Teva; Ibandronic Acid Accord; Ibandronic Acid Sandoz; [1-hydroxy-3-[methyl(pentyl)amino]-1-phosphonopropyl]phosphonic acid; Acido ibandronico; acide ibandronique; UMD7G2653W; NSC-722623; DTXSID5048340; RPR-102289A

    GHS hazard classification

    Reported hazard statementsH302 (95.2%), H315 (95.2%), H319 (95.2%), H335 (95.2%)

    H302 (95.2%): Harmful if swallowed [Warning Acute toxicity, oral]

    H315 (95.2%): Causes skin irritation [Warning Skin corrosion/irritation]

    What the public record says

    ibandronic acid · CAS 114084-78-5 · C9H23NO7P2. UNII UMD7G2653W. Melting Point: 113-115; Solubility: 1.34e+01 g/L; LogP: -2.1.

    Physical description and handling notes

    Source: PubChem / Wikidata; the batch COA governs where values differ.

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