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CAS 10035-04-8 Calcium chloride dihydrate molecular structure lightbox
CAS RN: 10035-04-8

Calcium chloride dihydrate

  • Product code: SSC-000854
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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: 500g
  • 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 10035-04-8
Pack Size Recorded Purity Available Qty Ship From Inquiry
500g ≥95% 0 Out of Stock Hong Kong Inquiry

10035-04-8 / calcium;dichloride;dihydrate

calcium;dichloride;dihydrate | Conclyte-Ca (TN) | Calcium chloride (USP)

Standard CAS: 10035-04-8 Multi CAS: Yes
Basic Information Computed Properties Safety & Transport

Basic Information

CAS
10035-04-8
Multi CAS
Yes
Molecular Formula
CaCl2H4O2
Molecular Weight
147.010000
Exact Mass
145.921426
SMILES
O.O.[Cl-].[Cl-].[Ca+2]
InChI
InChI=1S/Ca.2ClH.2H2O/h;2*1H;2*1H2/q+2;;;;/p-2
InChIKey
LLSDKQJKOVVTOJ-UHFFFAOYSA-L
Synonyms
calcium;dichloride;dihydrate Conclyte-Ca (TN) Calcium chloride (USP) UNII-M4I0D6VV5M Calcium chloride [USP:JAN]

Computed Properties

Structural Parameters

Heavy atom count
5
H-bond acceptors
4
H-bond donors
2
Molar refractivity
12.98
TPSA
63

LogP / Solubility

WLOGP
-8.02
MLOGP
-7.07
XLogP3
-8.02
Consensus LogP
-7.7
Log S (ESOL)
4.3
Class (ESOL)
Highly soluble
Log S (Ali)
5.03
Class (Ali)
Highly soluble
Log S (SILICOS-IT)
6.04
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)
-9.31

Drug-likeness / Medicinal Chemistry

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

Safety & Transport

Pictogram(s)
Irritant
Signal
Warning
GHS Hazard Statements
H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]
Precautionary Statement Codes
P264+P265, P280, P305+P351+P338, and P337+P317

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