5-(4-Chloro-2-nitrophenyl)furfural - CAS 480439-09-6

Name: 5-(4-Chloro-2-nitrophenyl)furfural
Brand: BOC Sciences
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Catalog:	BB026475
Product Name:	5-(4-Chloro-2-nitrophenyl)furfural
CAS:	480439-09-6
Synonyms:	5-(4-chloro-2-nitrophenyl)furan-2-carbaldehyde

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Computed Properties

IUPAC Name:	5-(4-chloro-2-nitrophenyl)furan-2-carbaldehyde
Description:	5-(4-Chloro-2-nitrophenyl)furfural (CAS# 480439-09-6) is a useful research chemical.
Molecular Weight:	251.62
Molecular Formula:	C11H6ClNO4
Canonical SMILES:	C1=CC(=C(C=C1Cl)[N+](=O)[O-])C2=CC=C(O2)C=O
InChI:	InChI=1S/C11H6ClNO4/c12-7-1-3-9(10(5-7)13(15)16)11-4-2-8(6-14)17-11/h1-6H
InChI Key:	QUHBWTNARIJFIJ-UHFFFAOYSA-N
Boiling Point:	402.2 °C at 760 mmHg
Density:	1.454 g/cm³
MDL:	MFCD02629523
LogP:	3.84390

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Related Functional Groups

Carbonyl Compounds

[87-88-7]C6H2Cl2O4
Chloranilic acid
[1018141-88-2]C17H14N4O2
1-(2-Cyanoethyl)-3-methyl-6-phenyl-1H-pyrazolo[3,4-b]pyridine-4-carboxylic acid
[832741-29-4]C9H11BrOS
1-(4-Bromo-5-propylthiophen-2-yl)ethanone
[1431966-64-1]C10H17ClN2O2S
1-{2-[(3-Methoxypropyl)amino]-4-methyl-1,3-thiazol-5-yl}ethanone hydrochloride
[865774-78-3]C16H21F2NO2
2-(6,8-difluoro-1,2,3,4-tetrahydro-naphthalen-2-ylamino)-pentanoic acid methyl ester
[927676-51-5]C10H6BrNO3
2-(6-Bromo-3-indolyl)-2-oxoacetic Acid

GHS Hazard Statement:	H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
Precautionary Statement:	P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501
Signal Word:	Warning

Publication Number	Title	Priority Date
KR-20120035684-A	Novel Thiazolidinone Compounds as IV-Î² Inhibitors and Methods for Preparing the Same	20101006
AU-2007210053-A1	Anabaseine derivatives, pharmaceutical compositions and methods of use thereof	20060126
CA-2637545-A1	Anabaseine derivatives, pharmaceutical compositions and methods of use thereof	20060126
JP-2009524682-A	Anabasine derivatives, pharmaceutical compositions and methods of use thereof	20060126
US-2007232651-A1	Novel anabaseine derivatives, pharmaceutical compositions and methods of use thereof	20060126

Complexity:	306
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	250.9985354
Formal Charge:	0
Heavy Atom Count:	17
Hydrogen Bond Acceptor Count:	4
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	250.9985354
Rotatable Bond Count:	2
Topological Polar Surface Area:	76 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	2.9