[4-[(Z)-4-(4-phosphonooxyphenyl)hex-3-en-3-yl]phenyl] dihydrogen phosphate

Base Information

• Chemical Name: [4-[(Z)-4-(4-phosphonooxyphenyl)hex-3-en-3-yl]phenyl] dihydrogen phosphate
• CAS No.: 13425-53-1
• Molecular Formula: C18H22 O8 P2
• Molecular Weight: 428.315
• Hs Code.: 2919900090
• European Community (EC) Number: 236-545-8
• ChEMBL ID: CHEMBL4742841
• Mol file: 13425-53-1.mol

Synonyms:EINECS 236-545-8;[4-[(Z)-4-(4-phosphonooxyphenyl)hex-3-en-3-yl]phenyl] dihydrogen phosphate;13425-53-1;alpha,alpha'-Diethyl-4,4'-stilbenediol diphosphate;[4-[4-(4-phosphonooxyphenyl)hex-3-en-3-yl]phenyl] dihydrogen phosphate;difostilben;fosfesterol;fostestrolum;fostrolin;Kyorin;Fosfestrol [INN:BAN:JAN];diethyldioxystilbene diphosphate;CHEMBL4742841;ST-52;LS-172890

Chemical Property of [4-[(Z)-4-(4-phosphonooxyphenyl)hex-3-en-3-yl]phenyl] dihydrogen phosphate

Chemical Property:

• Boiling Point: 648.7°Cat760mmHg
• Flash Point: 346.1°C
• PSA: 153.14000
• Density: 1.433g/cm³
• LogP: 4.31700
• XLogP3: 2.5
• Hydrogen Bond Donor Count: 4
• Hydrogen Bond Acceptor Count: 8
• Rotatable Bond Count: 8
• Exact Mass: 428.07899165
• Heavy Atom Count: 28
• Complexity: 568

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCC(=C(CC)C1=CC=C(C=C1)OP(=O)(O)O)C2=CC=C(C=C2)OP(=O)(O)O
• Isomeric SMILES: CC/C(=C(\CC)/C1=CC=C(C=C1)OP(=O)(O)O)/C2=CC=C(C=C2)OP(=O)(O)O

Technology Process of [4-[(Z)-4-(4-phosphonooxyphenyl)hex-3-en-3-yl]phenyl] dihydrogen phosphate

There total 1 articles about [4-[(Z)-4-(4-phosphonooxyphenyl)hex-3-en-3-yl]phenyl] dihydrogen phosphate which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield:

diethylstilbestrol (6898-97-1,22610-99-7,56-53-1,8053-00-7) → C18H22O8P2 (13425-53-1)

Guidance literature:

Multistep reaction; (i) POCl₃, Py, (ii) H₂O;

upstream raw materials:

diethylstilbestrol