2-(2-Thienyl)benzaldehyde - CAS 99902-07-5

Catalog:	BB042360
Product Name:	2-(2-Thienyl)benzaldehyde
CAS:	99902-07-5
Synonyms:	2-thiophen-2-ylbenzaldehyde; 2-thiophen-2-ylbenzaldehyde

Technical Data

Patents

Computed Properties

IUPAC Name:	2-thiophen-2-ylbenzaldehyde
Description:	2-(2-Thienyl)benzaldehyde (CAS# 99902-07-5) is a useful research chemical.
Molecular Weight:	188.25
Molecular Formula:	C11H8OS
Canonical SMILES:	C1=CC=C(C(=C1)C=O)C2=CC=CS2
InChI:	InChI=1S/C11H8OS/c12-8-9-4-1-2-5-10(9)11-6-3-7-13-11/h1-8H
InChI Key:	MWYVQGTVFMAUOH-UHFFFAOYSA-N
Boiling Point:	331 °C at 760 mmHg
Density:	1.207 g/cm³
MDL:	MFCD04039148
LogP:	3.22760

Publication Number	Title	Priority Date
KR-20210089129-A	Benzimidazole compounds and their use for treating Alzheimer's disease or Huntington's disease	20180831
AU-2017207003-A1	Novel phosphinane and azaphosphinane derivatives, method for preparing same and pharmaceutical compositions containing same	20160114
AU-2017207003-A2	Novel phosphinane and azaphosphinane derivatives, method for preparing same and pharmaceutical compositions containing same	20160114
CA-3011184-A1	Novel phosphinane and azaphosphinane derivatives, method for preparing same and pharmaceutical compositions containing same	20160114
DK-3271368-T3	NEW PHOSPHINAN AND AZAPHOSPHINAN DERIVATIVES, PROCEDURE FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THESE	20160114

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Complexity:	181
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	188.02958605
Formal Charge:	0
Heavy Atom Count:	13
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	188.02958605
Rotatable Bond Count:	2
Topological Polar Surface Area:	45.3
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	2.7