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2-(2-Isopropyl-4-methoxyphenoxy)acetonitrile

2-(2-Isopropyl-4-methoxyphenoxy)acetonitrile - CAS 927872-64-8

Catalog:	BB040631
Product Name:	2-(2-Isopropyl-4-methoxyphenoxy)acetonitrile
CAS:	927872-64-8
Synonyms:	2-(4-methoxy-2-propan-2-ylphenoxy)acetonitrile; 2-(4-methoxy-2-propan-2-ylphenoxy)acetonitrile

Technical Data

Patents

Computed Properties

IUPAC Name:	2-(4-methoxy-2-propan-2-ylphenoxy)acetonitrile
Description:	2-(2-Isopropyl-4-methoxyphenoxy)acetonitrile (CAS# 927872-64-8 ) is a useful research chemical.
Molecular Weight:	205.25
Molecular Formula:	C12H15NO2
Canonical SMILES:	CC(C)C1=C(C=CC(=C1)OC)OCC#N
InChI:	InChI=1S/C12H15NO2/c1-9(2)11-8-10(14-3)4-5-12(11)15-7-6-13/h4-5,8-9H,7H2,1-3H3
InChI Key:	VYWGSKTVJRQMBI-UHFFFAOYSA-N
LogP:	2.72098

Publication Number	Title	Priority Date
WO-2019209607-A1	Novel process for synthesis of a phenoxy diaminopyrimidine compound	20180423
AU-2019257606-A1	Novel process for synthesis of a phenoxy diaminopyrimidine compound	20180423
BR-112020020549-A2	NEW PROCESS FOR THE SYNTHESIS OF A DIAMINOPYRIMIDINE PHENOXY COMPOUND	20180423
CN-112423756-A	Novel process for the synthesis of phenoxydiaminopyrimidine compounds	20180423
EP-3784242-A1	Novel process for synthesis of a phenoxy diaminopyrimidine compound	20180423

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Related Functional Groups

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
[333311-69-6]
1-(4-Bromobenzyl)-3,5-dimethyl-4-nitro-1H-pyrazole
[51355-91-0]
1-(Chloromethyl)-3,5-dimethyl-4-nitro-1H-pyrazole
[102388-00-1]
1-(Chloromethyl)-3-nitro-1H-pyrazole
[55877-31-1]
1-Benzofuran-3-carbonitrile
[78056-67-4]
2-(1-Benzyl-4-piperidyl)acetonitrile

Complexity:	231
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	205.110278721
Formal Charge:	0
Heavy Atom Count:	15
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	205.110278721
Rotatable Bond Count:	4
Topological Polar Surface Area:	42.2
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	2.8