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CAS 138926-19-9 Ibandronate sodium monohydrate molecular structure lightbox
CAS RN: 138926-19-9

Ibandronate sodium monohydrate

Product Availability

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7 package records6 with current stock3 grade groups
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20260120 50mg / 250mg / 1g / 5g / 25g Confirm by inquiry Shanghai, Shandong Inquiry
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20250713 1ml Out of stock 8-10 business days Inquiry
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20251027 100g In stock Shanghai Inquiry
Batchno.20250721 10g In stock Shanghai Inquiry
Batchno.20250713 1g In stock Shanghai Inquiry
Batchno.20250206 25g In stock Shanghai Inquiry
Batchno.20251025 5g In stock Shanghai Inquiry
  • Product code: SSC-049058
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Historical Factory Record

Historical Supply Reference

This product has historical factory records. Recorded pack sizes and purity can be used as a supply reference, while project-specific availability is confirmed by inquiry.

  • Pack sizes on record: 5g
  • Available purity: ≥95%
  • Inventory rows with stock: 0
  • Bulk packaging: confirmed by inquiry
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Reference Pack Sizes

Reference pack sizes are shown below. Final availability, packaging and delivery schedule are confirmed by inquiry.

Recorded sizes, purity and stock details for CAS 138926-19-9
Pack Size Recorded Purity Available Qty Ship From Inquiry
5g ≥95% 0 Out of Stock Beijing Inquiry

138926-19-9 / sodium;hydroxy-[1-hydroxy-3-[methyl(pentyl)amino]-1-phosphonopropyl]phosphinate;hydrate

Standard CAS: 138926-19-9 Multi CAS: No
Basic Information Computed Properties Safety & Transport

Basic Information

CAS
138926-19-9
Multi CAS
No
Molecular Formula
C9H24NNaO8P2
Molecular Weight
359.230000
Exact Mass
359.087485
SMILES
CCCCCN(C)CCC(O)(P(=O)(O)O)P(=O)(O)[O-].O.[Na+]
InChI
InChI=1S/C9H23NO7P2.Na.H2O/c1-3-4-5-7-10(2)8-6-9(11,18(12,13)14)19(15,16)17;;/h11H,3-8H2,1-2H3,(H2,12,13,14)(H2,15,16,17);;1H2/q;+1;/p-1
InChIKey
VBDRTGFACFYFCT-UHFFFAOYSA-M

Computed Properties

Structural Parameters

Heavy atom count
21
Fraction Csp3
1
Rotatable bonds
9
H-bond acceptors
5
H-bond donors
4
Molar refractivity
72.07
TPSA
172.86

LogP / Solubility

WLOGP
-3.95
MLOGP
-3.46
XLogP3
-3.95
Consensus LogP
-3.79
Log S (ESOL)
1.02
Class (ESOL)
Highly soluble
Log S (Ali)
0.35
Class (Ali)
Highly soluble
Log S (SILICOS-IT)
0.21
Class (SILICOS-IT)
Highly soluble

ADME

GI absorption
Low
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-7.72

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
No
Egan
No
Muegge
No
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
3.5

Safety & Transport

Pictogram(s)
Corrosive Irritant Health Hazard Environmental Hazard
Signal
Danger Warning
GHS Hazard Statements
H302 (70%): Harmful if swallowed [Warning Acute toxicity, oral] H312 (10%): Harmful in contact with skin [Warning Acute toxicity, dermal] H314 (40%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation] H315 (40%): Causes skin irritation [Warning Skin corrosion/irritation] H318 (20%): Causes serious eye damage [Danger Serious eye damage/eye irritation]
Precautionary Statement Codes
P203, P260, P261, P263, P264, P264+P265, P270, P271, P273, P280, P301+P317, P301+P330+P331, P302+P352, P302+P361+P354, P304+P340, P305+P351+P338, P305+P354+P338, P308+P316, P316, P317, P318, P319, P321, P330, P332+P317, P337+P317, P362+P364, P363, P391, P403+P233, P405, and P501 P260, P264, P270, P273, P301+P317, P308+P316, P319, P330, P391, P405, and P501

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