4-Biphenylylpyruvic Acid - CAS 91853-46-2

Name: 4-Biphenylylpyruvic Acid
Brand: BOC Sciences
Rating: 5 (1 reviews)

Catalog:	BB061732
Product Name:	4-Biphenylylpyruvic Acid
CAS:	91853-46-2
Synonyms:	2-oxo-3-(4-phenylphenyl)propanoic acid; [1,1'-Biphenyl]-4-propanoic acid, .alpha.-oxo-; 3-{[1,1'-BIPHENYL]-4-YL}-2-OXOPROPANOIC ACID; 4-biphenyl-pyruvic acid; 4-Biphenylylpyruvic Acid; 4-biphenylyl-pyruvic acid; 4-Phenylphenylpyruvic Acid

Technical Data

Safety and Hazards

Patents

Computed Properties

IUPAC Name:	2-oxo-3-(4-phenylphenyl)propanoic acid
Molecular Weight:	240.25
Molecular Formula:	C15H12O3
Canonical SMILES:	C1=CC=C(C=C1)C2=CC=C(C=C2)CC(=O)C(=O)O
InChI:	InChI=1S/C15H12O3/c16-14(15(17)18)10-11-6-8-13(9-7-11)12-4-2-1-3-5-12/h1-9H,10H2,(H,17,18)
InChI Key:	YLSFJNHIOYAOHZ-UHFFFAOYSA-N

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Related Functional Groups

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GHS Hazard Statement:	H302 (50%): Harmful if swallowed [Warning Acute toxicity, oral]
Precautionary Statement:	P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501
Signal Word:	Warning

Publication Number	Title	Priority Date
EP-3558930-A1	New process for early sacubitril intermediates	20161223
JP-2020502244-A	A new method for an early sacbitril intermediate	20161223
US-2019359554-A1	New process for early sacubitril intermediates	20161223
WO-2018116203-A1	New process for early sacubitril intermediates	20161223
US-10774036-B2	Process for early sacubitril intermediates	20161223
EP-3558930-B1	New process for early sacubitril intermediates	20161223
KR-101568336-B1	Cell producing mutant of target protein, preparing method thereof, and producing method of mutant of target protein using the cell	20130702
KR-20150004095-A	Cell producing mutant of target protein, preparing method thereof, and producing method of mutant of target protein using the cell	20130702
KR-100641825-B1	Method for producing 4-biphenylacetic acid	20031105
KR-20050043131-A	Preparation method of 4-biphenylacetic acid	20031105

Complexity:	297
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	240.078644241
Formal Charge:	0
Heavy Atom Count:	18
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	240.078644241
Rotatable Bond Count:	4
Topological Polar Surface Area:	54.4Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	2.9