2-(5-Bromo-2-pyridyl)-2-propanol - CAS 290307-40-3

Catalog:	BB020055
Product Name:	2-(5-Bromo-2-pyridyl)-2-propanol
CAS:	290307-40-3
Synonyms:	2-(5-bromo-2-pyridinyl)-2-propanol; 2-(5-bromopyridin-2-yl)propan-2-ol

Technical Data

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Computed Properties

IUPAC Name:	2-(5-bromopyridin-2-yl)propan-2-ol
Description:	2-(5-Bromo-2-pyridyl)-2-propanol (CAS# 290307-40-3) is a useful research chemical.
Molecular Weight:	216.08
Molecular Formula:	C8H10BrNO
Canonical SMILES:	CC(C)(C1=NC=C(C=C1)Br)O
InChI:	InChI=1S/C8H10BrNO/c1-8(2,11)7-4-3-6(9)5-10-7/h3-5,11H,1-2H3
InChI Key:	RDQCATQYMZDJLU-UHFFFAOYSA-N
Boiling Point:	281.472 °C at 760 mmHg
Density:	1.475 g/cm³
MDL:	MFCD11865230
LogP:	2.07150

Publication Number	Title	Priority Date
WO-2021130259-A1	Dihydrocyclopenta-isoquinoline-sulfonamide derivatives compounds	20191223
CN-111094278-A	Diphenyl derivatives and their use	20170913
TW-201920112-A	Diphenyl derivative and its use	20170913
US-10633350-B2	Diphenyl derivatives and uses thereof	20170913
US-2019077773-A1	Diphenyl derivatives and uses thereof	20170913

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Complexity:	138
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	214.99458
Formal Charge:	0
Heavy Atom Count:	11
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	214.99458
Rotatable Bond Count:	1
Topological Polar Surface Area:	33.1
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	1.3