2,3-Dibromo-5-ethoxy-4-hydroxybenzonitrile - CAS 330462-59-4

Catalog:	BB044937
Product Name:	2,3-Dibromo-5-ethoxy-4-hydroxybenzonitrile
CAS:	330462-59-4
Synonyms:	2,3-dibromo-5-ethoxy-4-hydroxybenzenecarbonitrile; Benzonitrile, 2,3-dibromo-5-ethoxy-4-hydroxy-

Technical Data

Computed Properties

IUPAC Name:	2,3-dibromo-5-ethoxy-4-hydroxybenzonitrile
Description:	2,3-Dibromo-5-ethoxy-4-hydroxybenzonitrile (CAS# 330462-59-4 ) is a useful research chemical.
Molecular Weight:	320.96
Molecular Formula:	C9H7Br2NO2
Canonical SMILES:	CCOC1=C(C(=C(C(=C1)C#N)Br)Br)O
InChI:	InChI=1S/C9H7Br2NO2/c1-2-14-6-3-5(4-12)7(10)8(11)9(6)13/h3,13H,2H2,1H3
InChI Key:	MFOYUMYOZXEHIH-UHFFFAOYSA-N
Boiling Point:	354.8±42.0 °C at 760 mmHg
Purity:	≥ 95 %
Density:	2.0±0.1 g/cm³

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Related Functional Groups

Alcohols and Derivatives

[62972-93-4]
(Z)-11-Octadecen-1-ol
[1946823-77-3]
[1,4-Dimethyl-3-(trifluoromethyl)-1H-pyrazol-5-yl]methanol
[1448610-48-7]
1-(4-Bromo-3-methylphenyl)cyclobutanol
[18621-17-5]
1-Benzhydrylazetan-3-ol
[2006278-33-5]
2-(6-Methoxy-2-naphthyl)-4-pentyn-2-ol
[6712-35-2]
2-Phenyl-4-pentyn-2-ol

Halides

[1448610-48-7]
1-(4-Bromo-3-methylphenyl)cyclobutanol
[832741-29-4]
1-(4-Bromo-5-propylthiophen-2-yl)ethanone
[2367-82-0]
1,2,3,5-Tetrafluorobenzene
[452-76-6]
2,4-Difluorotoluene
[35989-28-7]
2,5-Dichloro-4-fluorobenzoic acid
[393841-81-1]
2'-Bromo-2,7-DI-tert-butyl-9,9'-spirobi[fluorene]

Nitrogen Compounds

[89908-23-6]
2-Propenoic acid, 2-(3',3'-dimethyl-6-nitrospiro[2H-1-benzopyran-2,2'-[2H]indol]-1'(3'H)-yl)ethyl ester
[937273-31-9]
2-[(Allyloxy)methyl]-1-(2-chloroethoxy)-4-nitrobenzene
[618-40-6]
1-Methyl-1-phenylhydrazine
[865774-78-3]
2-(6,8-difluoro-1,2,3,4-tetrahydro-naphthalen-2-ylamino)-pentanoic acid methyl ester
[2006278-12-0]
2-[(5-Bromo-3-pyridyl)oxy]-2-phenylacetonitrile
[5724-76-5]
3-(2,5-Dioxopyrrolidin-1-yl)propionic acid

Complexity:	240
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	320.8823
Formal Charge:	0
Heavy Atom Count:	14
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	318.88435
Rotatable Bond Count:	2
Topological Polar Surface Area:	53.2
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	3