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1-Octadecanol, 9,10-dibromo-, 1,1'-(hydrogen phosphate), calcium salt (2:1) structure
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1-Octadecanol, 9,10-dibromo-, 1,1'-(hydrogen phosphate), calcium salt (2:1)

TL;DR: 1-Octadecanol, 9,10-dibromo-, 1,1'-(hydrogen phosphate), calcium salt (2:1) (CAS 68298-30-6) is a chemical compound with molecular formula C72H140Br8CaO8P2 and molecular weight 1866.3116 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

calcium bis(bis(9,10-dibromooctadecyl) phosphate)

Also Known As: Calcium bis(bis-dibromooleylphosphate), C36H71Br4O4P.1/2Ca, C36-H71-Br4-O4-P.1/2Ca, Calcium tetrakis(9,10-dibromooctadecyl) bis(phosphate), 1-Octadecanol, 9,10-dibromo-, hydrogen phosphate, calcium salt

CAS Number
68298-30-6
Molecular Formula
C72H140Br8CaO8P2
Molecular Weight
1866.3116 g/mol
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Technical Specifications

Molecular FormulaC72H140Br8CaO8P2
Molecular Weight1866.3116 g/mol
XLogP28.63
Topological Polar Surface Area (TPSA)117.0 Ų
Hydrogen Bond Donors0
Hydrogen Bond Acceptors8
Rotatable Bonds72
Exact Mass1874.3035 Da
Heavy Atoms91
Complexity602.0
SMILESCCCCCCCCC(C(CCCCCCCCOP(=O)([O-])OCCCCCCCCC(C(CCCCCCCC)Br)Br)Br)Br.CCCCCCCCC(C(CCCCCCCCOP(=O)([O-])OCCCCCCCCC(C(CCCCCCCC)Br)Br)Br)Br.[Ca+2]
InChIKeyMMIXQENPPAELDP-UHFFFAOYSA-L

Chemical Property Profile of 1-Octadecanol, 9,10-dibromo-, 1,1'-(hydrogen phosphate), calcium salt (2:1)

XLogP
28.63
TPSA (Topological Polar Surface Area)
117.0
Hydrogen Bond Donors
0
Hydrogen Bond Acceptors
8
Rotatable Bonds
72
Heavy Atoms
91
Complexity
602.0
Exact Mass
1874.3035
Monoisotopic Mass
1866.3116
Data Source: Chemical property values are referenced from PubChem, the world's largest open chemistry database maintained by the National Center for Biotechnology Information (NCBI), U.S. National Library of Medicine.

Property Insights of 1-Octadecanol, 9,10-dibromo-, 1,1'-(hydrogen phosphate), calcium salt (2:1)

The XLogP value of 28.63 indicates that 1-Octadecanol, 9,10-dibromo-, 1,1'-(hydrogen phosphate), calcium salt (2:1) is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 117.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-Octadecanol, 9,10-dibromo-, 1,1'-(hydrogen phosphate), calcium salt (2:1). Following Lipinski's Rule of Five, 1-Octadecanol, 9,10-dibromo-, 1,1'-(hydrogen phosphate), calcium salt (2:1) has 0 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.

Frequently Asked Questions

What is the CAS number of 1-Octadecanol, 9,10-dibromo-, 1,1'-(hydrogen phosphate), calcium salt (2:1)?

The CAS number of 1-Octadecanol, 9,10-dibromo-, 1,1'-(hydrogen phosphate), calcium salt (2:1) is 68298-30-6.

What is the molecular formula of 1-Octadecanol, 9,10-dibromo-, 1,1'-(hydrogen phosphate), calcium salt (2:1)?

The molecular formula of 1-Octadecanol, 9,10-dibromo-, 1,1'-(hydrogen phosphate), calcium salt (2:1) is C72H140Br8CaO8P2.

What is the molecular weight of 1-Octadecanol, 9,10-dibromo-, 1,1'-(hydrogen phosphate), calcium salt (2:1)?

The molecular weight of 1-Octadecanol, 9,10-dibromo-, 1,1'-(hydrogen phosphate), calcium salt (2:1) is 1866.3116 g/mol.

Where can I buy 1-Octadecanol, 9,10-dibromo-, 1,1'-(hydrogen phosphate), calcium salt (2:1)?

You can request a quote for 1-Octadecanol, 9,10-dibromo-, 1,1'-(hydrogen phosphate), calcium salt (2:1) directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for 1-Octadecanol, 9,10-dibromo-, 1,1'-(hydrogen phosphate), calcium salt (2:1)?

Yes, CoreyChem provides custom synthesis services for 1-Octadecanol, 9,10-dibromo-, 1,1'-(hydrogen phosphate), calcium salt (2:1) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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