Methyl 3-Formyl-5-methoxybenzoate - CAS 69026-10-4

Catalog:	BB033674
Product Name:	Methyl 3-Formyl-5-methoxybenzoate
CAS:	69026-10-4
Synonyms:	3-formyl-5-methoxybenzoic acid methyl ester; methyl 3-formyl-5-methoxybenzoate

Technical Data

Patents

Computed Properties

IUPAC Name:	methyl 3-formyl-5-methoxybenzoate
Description:	Methyl 3-Formyl-5-methoxybenzoate (CAS# 69026-10-4) is a useful research chemical.
Molecular Weight:	194.18
Molecular Formula:	C10H10O4
Canonical SMILES:	COC1=CC(=CC(=C1)C(=O)OC)C=O
InChI:	InChI=1S/C10H10O4/c1-13-9-4-7(6-11)3-8(5-9)10(12)14-2/h3-6H,1-2H3
InChI Key:	WFYPMONPCUQCRM-UHFFFAOYSA-N
LogP:	1.29430

Publication Number	Title	Priority Date
CN-102958912-A	Benzohydrol derivatives, a preparation process and pharmaceutical use thereof	20100810
WO-2012019428-A1	Benzohydrol derivatives, a preparation process and pharmaceutical use thereof	20100810
JP-2013047189-A	Novel paravanic acid derivatives and pharmaceuticals containing them as active ingredients	20091225
WO-2011078370-A1	Novel parabanic acid derivative and drug having the same as active ingredient	20091225
CA-2699787-A1	(3-hydroxy-4-amino-butan-2-yl)-3-(2-thiazol-2-yl-pyrrolidine-1-carbonyl) benzamide derivatives and related compounds as beta-secretase inhibitors for treating	20070924

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Complexity:	214
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	194.0579088
Formal Charge:	0
Heavy Atom Count:	14
Hydrogen Bond Acceptor Count:	4
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	194.0579088
Rotatable Bond Count:	4
Topological Polar Surface Area:	52.6
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	1.2