2-Methoxybenzaldehyde - CAS 135-02-4

Catalog:	BB008053
Product Name:	2-Methoxybenzaldehyde
CAS:	135-02-4
Synonyms:	o-Anisaldehyde; 2-(Methyloxy)benzaldehyde; 2-Anisaldehyde; 2-Methoxybenzenecarboxaldehyde; 2-Methoxyphenylformaldehyde; 6-Methoxybenzaldehyde; NSC 58960; Salicylaldehyde Methyl Ether; o-Formylanisole; o-Methoxybenzaldehyde

Technical Data

IUPAC Name:	2-methoxybenzaldehyde
Description:	2-Methoxybenzaldehyde is isolated from cinnamon essential oil (CEO) with antibacterial and antifungal activity.
Molecular Weight:	136.15
Molecular Formula:	C8H8O2
Canonical SMILES:	COC1=CC=CC=C1C=O
InChI:	InChI=1S/C8H8O2/c1-10-8-5-3-2-4-7(8)6-9/h2-6H,1H3
InChI Key:	PKZJLOCLABXVMC-UHFFFAOYSA-N
Boiling Point:	243.5±0.0°C at 760 mmHg
Melting Point:	36-39°C
Flash Point:	117°C
Purity:	≥98%
Density:	1.127 g/cm³
Solubility:	Soluble in Chloroform, DMSO, Ethyl Acetate
Appearance:	Off-white to Pale Yellow Low Melting Solid
Storage:	Store at 2-8°C, stored under nitrogen
MDL:	MFCD00003308
LogP:	1.50770
Refractive Index:	1.5608
Stability:	Stable under normal temperatures and pressures.
Vapor Pressure:	0.12 [mmHg]

GHS Hazard Statement:	H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
Precautionary Statement:	P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501
Signal Word:	Warning

Publication Number	Title	Priority Date
CN-113501950-A	Metal complex catalyst for effectively preparing biocompatible polycarbonate and application thereof	20210716
CN-113024440-A	Method for continuously synthesizing substituted indole-2-carboxylic acid	20210317
CN-112941549-A	Synthetic method of quinazoline derivative, benzoxazine derivative and benzothiazole derivative	20210226
CN-112898141-A	Method for preparing o-methoxybenzaldehyde by using dimethyl carbonate	20210128
CN-112851469-A	Method for synthesizing chiral deuterated primary alcohol	20210119

PMID	Publication Date	Title	Journal
22982389	20121201	Metal based new triazoles: their synthesis, characterization and antibacterial/antifungal activities	Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy
22590326	20120501	2-[(2-Meth-oxy-benzyl-idene)amino]-phenol	Acta crystallographica. Section E, Structure reports online
22589926	20120401	1-(4-Chloro-phen-yl)-2-[4-hy-droxy-3-(3-meth-oxy-benzo-yl)-1,1-dioxo-2H-1λ(6),2-benzothia-zin-2-yl]ethanone	Acta crystallographica. Section E, Structure reports online
22590033	20120401	2-[2-(3-Chloro-phen-yl)-2-oxoeth-yl]-4-hy-droxy-3-(3-meth-oxy-benzo-yl)-2H-1λ(6),2-benzothia-zine-1,1-dione	Acta crystallographica. Section E, Structure reports online
22281497	20120217	Cytochrome P450BM-3 reduces aldehydes to alcohols through a direct hydride transfer	Biochemical and biophysical research communications

Complexity:	112
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	136.052429494
Formal Charge:	0
Heavy Atom Count:	10
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	136.052429494
Rotatable Bond Count:	2
Topological Polar Surface Area:	26.3 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	1.7