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4,4'-Di-tert-butylbiphenyl

4,4'-Di-tert-butylbiphenyl - CAS 1625-91-8

Catalog:	BB011885
Product Name:	4,4'-Di-tert-butylbiphenyl
CAS:	1625-91-8
Synonyms:	1-tert-butyl-4-(4-tert-butylphenyl)benzene

Technical Data

Patents

Literatures

Computed Properties

IUPAC Name:	1-tert-butyl-4-(4-tert-butylphenyl)benzene
Description:	4,4'-Di-tert-butylbiphenyl (CAS# 1625-91-8) is a useful research chemical.
Molecular Weight:	266.42
Molecular Formula:	C20H26
Canonical SMILES:	CC(C)(C)C1=CC=C(C=C1)C2=CC=C(C=C2)C(C)(C)C
InChI:	InChI=1S/C20H26/c1-19(2,3)17-11-7-15(8-12-17)16-9-13-18(14-10-16)20(4,5)6/h7-14H,1-6H3
InChI Key:	CDKCEZNPAYWORX-UHFFFAOYSA-N
Boiling Point:	190-192 °C (13 mmHg)
Melting Point:	126-129 °C
Purity:	95 %
Density:	0.924 g/cm³
Appearance:	White powder, crystals, crystalline powder and/or chunks
MDL:	MFCD00008834
LogP:	5.94860

Publication Number	Title	Priority Date
US-2015261106-A1	Electrophotographic photosensitive member	20140313
US-2015253682-A1	Electrophotographic photosensitive member	20140307
WO-2015121840-A1	Process for the production of 21 -methoxy-11 -beta-phenyl-19-nor-pregna-4,9-diene-3,20-dione derivatives	20140217
WO-2015095339-A1	Synthesis of ent-progesterone and intermediates thereof	20131220
WO-2015071441-A2	Preparation of functionalised materials	20131114

PMID	Publication Date	Title	Journal
18714997	20080917	Alkali metal reductions of organic molecules: why mediated electron transfer from lithium is faster than direct reduction	Journal of the American Chemical Society
17990546	20070901	[Treatment of 4, 4'-dBB in aqueous solution using O3/H2O2 system and its synergetic kinetics]	Huan jing ke xue= Huanjing kexue
17703200	20070101	The partial reduction of electron-deficient pyrroles: procedures describing both Birch (Li/NH3) and ammonia-free (Li/DBB) conditions	Nature protocols
16525551	20060321	The ammonia-free partial reduction of substituted pyridinium salts	Organic & biomolecular chemistry
18007435	20040430	Masked omega-lithio ester enolates: synthetic applications	Molecules (Basel, Switzerland)

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Complexity:	253
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	266.203450829
Formal Charge:	0
Heavy Atom Count:	20
Hydrogen Bond Acceptor Count:	0
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	266.203450829
Rotatable Bond Count:	3
Topological Polar Surface Area:	0
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	7.7