2-(2-Bromophenyl)-2,2-difluoroacetic Acid - CAS 1375472-90-4

Catalog:	BB008621
Product Name:	2-(2-Bromophenyl)-2,2-difluoroacetic Acid
CAS:	1375472-90-4
Synonyms:	2-(2-bromophenyl)-2,2-difluoroacetic acid; 2-(2-bromophenyl)-2,2-difluoroacetic acid

Technical Data

Patents

Computed Properties

IUPAC Name:	2-(2-bromophenyl)-2,2-difluoroacetic acid
Description:	2-(2-Bromophenyl)-2,2-difluoroacetic Acid (CAS# 1375472-90-4) is a useful research chemical.
Molecular Weight:	251.02
Molecular Formula:	C8H5BrF2O2
Canonical SMILES:	C1=CC=C(C(=C1)C(C(=O)O)(F)F)Br
InChI:	InChI=1S/C8H5BrF2O2/c9-6-4-2-1-3-5(6)8(10,11)7(12)13/h1-4H,(H,12,13)
InChI Key:	ALUGEFZIOIIHCE-UHFFFAOYSA-N

Publication Number	Title	Priority Date
JP-2021515788-A	Selective inhibitor of protein arginine methyltransferase 5 (PRMT5)	20180314
EP-3504185-A1	Novel substituted n'-hydroxycarbamimidoyl-1,2,5-oxadiazole compounds as indoleamine 2,3-dioxygenase (ido) inhibitors	20160829
WO-2018044663-A1	Novel substituted n'-hydroxycarbamimidoyl-1,2,5-oxadiazole compounds as indoleamine 2,3-dioxygenase (ido) inhibitors	20160829
US-2020231606-A1	Novel substituted n'-hydroxycarbamimidoyl-1,2,5-oxadiazole compounds as indoleamine 2,3-dioxygenase (ido) inhibitors	20160829
US-10988487-B2	Substituted nâ€²-hydroxycarbamimidoyl-1,2,5-oxadiazole compounds as indoleamine 2,3-dioxygenase (IDO) inhibitors	20160829

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Complexity:	208
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	249.9441
Formal Charge:	0
Heavy Atom Count:	13
Hydrogen Bond Acceptor Count:	4
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	249.9441
Rotatable Bond Count:	2
Topological Polar Surface Area:	37.3
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	2.8