6-(2-Thienyl)-2-pyridinecarboxaldehyde - CAS 208111-00-6

Catalog:	BB016317
Product Name:	6-(2-Thienyl)-2-pyridinecarboxaldehyde
CAS:	208111-00-6
Synonyms:	6-thiophen-2-ylpyridine-2-carbaldehyde

Technical Data

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Computed Properties

IUPAC Name:	6-thiophen-2-ylpyridine-2-carbaldehyde
Description:	6-(2-Thienyl)-2-pyridinecarboxaldehyde (CAS# 208111-00-6) is a useful research chemical.
Molecular Weight:	189.23
Molecular Formula:	C10H7NOS
Canonical SMILES:	C1=CC(=NC(=C1)C=O)C2=CC=CS2
InChI:	InChI=1S/C10H7NOS/c12-7-8-3-1-4-9(11-8)10-5-2-6-13-10/h1-7H
InChI Key:	HZFJKPQZABOKLA-UHFFFAOYSA-N
Boiling Point:	324.663 °C at 760 mmHg
Purity:	95 %
Density:	1.269 g/cm³
Appearance:	White to tan solid
MDL:	MFCD06410007
LogP:	2.62260

Publication Number	Title	Priority Date
EP-3129102-A1	Iodonium analogs as inhibitors of nadph oxidases and other flavin dehydrogenases; formulations thereof; and uses thereof	20140407
US-10131659-B2	Iodonium analogs as inhibitors of NADPH oxidases and other flavin dehydrogenases; formulations thereof; and uses thereof	20140407
US-2017029424-A1	Iodonium analogs as inhibitors of nadph oxidases and other flavin dehydrogenases; formulations thereof; and uses thereof	20140407
US-2019048001-A1	Iodonium analogs as inhibitors of nadph oxidases and other flavin dehydrogenases; formulations thereof; and uses thereof	20140407
WO-2015157145-A1	Iodonium analogs as inhibitors of nadph oxidases and other flavin dehydrogenases; formulations thereof; and uses thereof	20140407

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Related Functional Groups

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GHS Hazard Statement:	H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
Precautionary Statement:	P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P310, P312, P321, P330, P332+P313, P362, P403+P233, P405, and P501
Signal Word:	Danger

Complexity:	186
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	189.02483502
Formal Charge:	0
Heavy Atom Count:	13
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	189.02483502
Rotatable Bond Count:	2
Topological Polar Surface Area:	58.2 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	2