5-Chloro-2-phenylimidazole-4-carbaldehyde - CAS 60367-52-4

Name: 5-Chloro-2-phenylimidazole-4-carbaldehyde
Brand: BOC Sciences
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Catalog:	BB030668
Product Name:	5-Chloro-2-phenylimidazole-4-carbaldehyde
CAS:	60367-52-4
Synonyms:	5-chloro-2-phenyl-1H-imidazole-4-carboxaldehyde; 5-chloro-2-phenyl-1H-imidazole-4-carbaldehyde

Technical Data

Safety and Hazards

Patents

Computed Properties

IUPAC Name:	5-chloro-2-phenyl-1H-imidazole-4-carbaldehyde
Description:	5-Chloro-2-phenylimidazole-4-carbaldehyde (CAS# 60367-52-4) is a useful research chemical.
Molecular Weight:	206.63
Molecular Formula:	C10H7ClN2O
Canonical SMILES:	C1=CC=C(C=C1)C2=NC(=C(N2)Cl)C=O
InChI:	InChI=1S/C10H7ClN2O/c11-9-8(6-14)12-10(13-9)7-4-2-1-3-5-7/h1-6H,(H,12,13)
InChI Key:	CCXUATWKEDQRMP-UHFFFAOYSA-N
Boiling Point:	440.8 °C at 760 mmHg
Density:	1.378 g/cm³
MDL:	MFCD01935953
LogP:	2.54260

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Related Functional Groups

Carbonyl Compounds

[35153-16-3]C16H30O2
(Z)-10-Tetradecenyl Acetate
[55441-25-3]C8H7N3O
1-(2-Cyanophenyl)urea
[1006443-01-1]C9H6N4O4
1-(5-Nitropyridin-2-yl)-1H-pyrazole-3-carboxylic acid
[832741-29-4]C9H11BrOS
1-(4-Bromo-5-propylthiophen-2-yl)ethanone
[927676-51-5]C10H6BrNO3
2-(6-Bromo-3-indolyl)-2-oxoacetic Acid
[328270-02-6]C11H16N2OS
2-Amino-6-ethyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide

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

Publication Number	Title	Priority Date
US-2015031833-A1	Formylpyrrole-based heterocycles for nucleic acid attachment to supports	20110119
US-2016137677-A1	Formylpyrrole-based heterocycles for nucleic acid attachment to supports	20110119
US-8883764-B1	Formylpyrrole-based heterocycles for nucleic acid attachment to supports	20110119
US-9273074-B2	Formylpyrrole-based heterocycles for nucleic acid attachment to supports	20110119
US-9475831-B2	Formylpyrrole-based heterocycles for nucleic acid attachment to supports	20110119

Complexity:	206
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	206.0246905
Formal Charge:	0
Heavy Atom Count:	14
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	206.0246905
Rotatable Bond Count:	2
Topological Polar Surface Area:	45.8 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	2.5