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Methyl 7-Methoxy-2-methylbenzoxazole-5-carboxylate

Methyl 7-Methoxy-2-methylbenzoxazole-5-carboxylate - CAS 1197944-26-5

Catalog:	BB004632
Product Name:	Methyl 7-Methoxy-2-methylbenzoxazole-5-carboxylate
CAS:	1197944-26-5
Synonyms:	7-methoxy-2-methyl-1,3-benzoxazole-5-carboxylic acid methyl ester; methyl 7-methoxy-2-methyl-1,3-benzoxazole-5-carboxylate

Technical Data

Patents

Computed Properties

IUPAC Name:	methyl 7-methoxy-2-methyl-1,3-benzoxazole-5-carboxylate
Description:	Methyl 7-Methoxy-2-methylbenzoxazole-5-carboxylate (CAS# 1197944-26-5 ) is a useful research chemical.
Molecular Weight:	221.21
Molecular Formula:	C11H11NO4
Canonical SMILES:	CC1=NC2=C(O1)C(=CC(=C2)C(=O)OC)OC
InChI:	InChI=1S/C11H11NO4/c1-6-12-8-4-7(11(13)15-3)5-9(14-2)10(8)16-6/h4-5H,1-3H3
InChI Key:	MSVIYBOHETWCGT-UHFFFAOYSA-N
Storage:	Sealed in dry, 2-8 °C
LogP:	1.93140

Publication Number	Title	Priority Date
CA-2724774-A1	Pyrazolospiroketone acetyl-coa carboxylase inhibitors	20080528
CA-2724774-C	Pyrazolospiroketone acetyl-coa carboxylase inhibitors	20080528
EP-2297163-A1	Pyrazolospiroketone acetyl-c0a carboxylase inhibitors	20080528
EP-2297163-B1	Pyrazolospiroketone acetyl-CoA carboxylase inhibitors	20080528
ES-2545231-T3	Pyrazoloespirocetone acetyl-CoA carboxylase inhibitors	20080528

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Related Functional Groups

Carbonyl Compounds

[1383427-98-2]
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[959574-98-2]
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[70199-62-1]
(4-Pyridyl)acetone Hydrochloride
[35153-16-3]
(Z)-10-Tetradecenyl Acetate
[1006443-01-1]
1-(5-Nitropyridin-2-yl)-1H-pyrazole-3-carboxylic acid
[956439-56-8]
1-(Carboxymethyl)-3-nitro-1H-pyrazole-5-carboxylic acid

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Complexity:	271
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	221.06880783
Formal Charge:	0
Heavy Atom Count:	16
Hydrogen Bond Acceptor Count:	5
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	221.06880783
Rotatable Bond Count:	3
Topological Polar Surface Area:	61.6
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	2