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CAS 118072-93-8 Zoledronic acid molecular structure lightbox
CAS RN: 118072-93-8

Zoledronic acid

Product Availability

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10 package records10 with current stock2 grade groups
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20260518 100mg In stock Shanghai Inquiry
Batchno.20251106 1g In stock Shanghai Inquiry
Batchno.20260518 250mg In stock Shanghai Inquiry
Batchno.20260317 5g In stock Shanghai Inquiry
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20260504 100mg In stock Inquiry
Batchno.20260124 1g In stock Inquiry
Batchno.20250401 200mg In stock Inquiry
Batchno.20260110 25g In stock Inquiry
Batchno.20251008 25mg In stock Inquiry
Batchno.20251120 5g In stock Inquiry
  • Product code: SSC-017907
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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: 1g
  • 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 118072-93-8
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ≥95% 0 Out of Stock Shanghai Inquiry

118072-93-8 / (1-hydroxy-2-imidazol-1-yl-1-phosphonoethyl)phosphonic acid

Zoledronic acid | Zoledronate | Zometa

Standard CAS: 118072-93-8 Multi CAS: Yes
Basic Information Physical Properties Computed Properties Safety & Transport

Basic Information

CAS
118072-93-8
Multi CAS
Yes
Molecular Formula
C5H10N2O7P2
Molecular Weight
272.090000
Exact Mass
271.996325
SMILES
C1=CN(C=N1)CC(O)(P(=O)(O)O)P(=O)(O)O
InChI
InChI=1S/C5H10N2O7P2/c8-5(15(9,10)11,16(12,13)14)3-7-2-1-6-4-7/h1-2,4,8H,3H2,(H2,9,10,11)(H2,12,13,14)
InChIKey
XRASPMIURGNCCH-UHFFFAOYSA-N
Synonyms
Zoledronic acid Zoledronate Zometa Reclast Aclasta

Physical Properties

Physical Description
Solid
State
Solid

Computed Properties

Structural Parameters

Heavy atom count
16
Aromatic heavy atom count
5
Fraction Csp3
0.4
Rotatable bonds
4
H-bond acceptors
5
H-bond donors
5
Molar refractivity
51.27
TPSA
153.11

LogP / Solubility

WLOGP
-1.12
MLOGP
-0.97
XLogP3
-4.3
Consensus LogP
-2.13
Log S (ESOL)
-0.79
Class (ESOL)
Very soluble
Log S (Ali)
-0.99
Class (Ali)
Very soluble
Log S (SILICOS-IT)
-0.98
Class (SILICOS-IT)
Very 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)
-5.17

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
No
Egan
No
Muegge
No
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
Yes
Synthetic Accessibility
1.5

Safety & Transport

Pictogram(s)
Irritant
Signal
Warning
GHS Hazard Statements
H317 (100%): May cause an allergic skin reaction [Warning Sensitization, Skin] H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]
Precautionary Statement Codes
P261, P264+P265, P272, P280, P302+P352, P305+P351+P338, P321, P333+P317, P337+P317, P362+P364, and P501

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