5-Phenyl-1-trityltetrazole - CAS 154750-11-5

Catalog:	BB011053
Product Name:	5-Phenyl-1-trityltetrazole
CAS:	154750-11-5
Synonyms:	5-phenyl-1-(triphenylmethyl)tetrazole; 5-phenyl-1-trityltetrazole

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Computed Properties

IUPAC Name:	5-phenyl-1-trityltetrazole
Description:	5-Phenyl-1-trityltetrazole (CAS# 154750-11-5 ) is a useful research chemical.
Molecular Weight:	388.46
Molecular Formula:	C26H20N4
Canonical SMILES:	C1=CC=C(C=C1)C2=NN=NN2C(C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5
InChI:	InChI=1S/C26H20N4/c1-5-13-21(14-6-1)25-27-28-29-30(25)26(22-15-7-2-8-16-22,23-17-9-3-10-18-23)24-19-11-4-12-20-24/h1-20H
InChI Key:	VGZPWMFEPXVLHI-UHFFFAOYSA-N
LogP:	5.18030

Publication Number	Title	Priority Date
US-10300471-B2	Ruthenium-catalyzed synthesis of biaryl compounds in water	20131008
US-2016263565-A1	Ruthenium-catalyzed synthesis of biaryl compounds in water	20131008
WO-2015054120-A1	Ruthenium-catalyzed synthesis of biaryl compounds in water	20131008
EP-2526095-A1	Dual-acting thiophene, pyrrole, thiazole and furan antihypertensive agents	20100119
JP-2013517295-A	Dual acting thiophene, pyrrole, thiazole and furan antihypertensive drugs	20100119

PMID	Publication Date	Title	Journal
20502651	20100318	A short and efficient synthesis of valsartan via a Negishi reaction	Beilstein journal of organic chemistry

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Related Functional Groups

Triazole/Tetrazole

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5-(4-Methoxyphenyl)-2H-tetrazole
[1005680-56-7]
Ethyl ({4-ethyl-5-[1-methyl-5-(trifluoromethyl)-1H-pyrazol-3-YL]-4H-1,2,4-triazol-3-YL}thio)acetate
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ethyl 1-methyl-1H-1,2,3,4-tetrazole-5-carboxylate
[1823402-59-0]
Ethyl 2-(5-bromo-1H-1,2,4-triazol-1-yl)butanoate
[1823829-53-3]
Ethyl 2-(5-chloro-1H-1,2,4-triazol-1-yl)propanoate

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Complexity:	468
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	388.16879665
Formal Charge:	0
Heavy Atom Count:	30
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	388.16879665
Rotatable Bond Count:	5
Topological Polar Surface Area:	43.6
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	6