CAS 84290-49-3

1 2D Structure

2D Structure

2 Identification

2.1 Computed Descriptors

2.1.1 IUPAC Name

2-hydroxy-6-(methoxymethoxy)benzaldehyde

2.1.2 InChI

InChI=1S/C9H10O4/c1-12-6-13-9-4-2-3-8(11)7(9)5-10/h2-5,11H,6H2,1H3

2.1.3 InChI Key

GSHNZOVUGRZEON-UHFFFAOYSA-N

2.1.4 Canonical SMILES

COCOC1=CC=CC(=C1C=O)O

2.2 Synonyms

2.2.1 Depositor-Supplied Synonyms

1. 84290-49-3

2. Schembl10922927

3. Gshnzovugrzeon-uhfffaoysa-n

4. Mfcd24674686

5. 2-hydroxy-6-methoxymethoxybenzaldehyde

6. Ft-0729569

2.3 Create Date

2007-02-09

3 Chemical and Physical Properties

Molecular Formula	C₉H₁₀O₄
Molecular Weight	182.17 g/mol
XLogP3	1.5
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	4
Exact Mass	g/mol
Monoisotopic Mass	g/mol
Topological Polar Surface Area	55.8
Heavy Atom Count	13
Formal Charge	0
Complexity	160
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently Bonded Unit Count	1

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