AG003MO7

89938-56-7 | 5-Chloro-4-methoxysalicylaldehyde

AG003MO7

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CAS Number	89938-56-7
Catalog Number	AG003MO7(AGN-PC-0ALJ0T)
Chemical Name	5-Chloro-4-methoxysalicylaldehyde
IUPAC Name	5-chloro-2-hydroxy-4-methoxybenzaldehyde
InChI	InChI=1S/C8H7ClO3/c1-12-8-3-7(11)5(4-10)2-6(8)9/h2-4,11H,1H3
InChI Key	ZZMHVBPSRKMWLT-UHFFFAOYSA-N
MDL Number	MFCD08059080
Molecular Formula	C8H7ClO3
Molecular Weight	186.5924
SMILES	OC1=CC(OC)=C(Cl)C=C1C=O
Synonyms	5-Chloro-4-methoxysalicylaldehyde, 89938-56-7, 5-chloro-2-hydroxy-4-methoxyBenzaldehyde, 5-Chloro-2-hydroxy-4-methoxy-benzaldehyde, Benzaldehyde, 5-chloro-2-hydroxy-4-methoxy-, SCHEMBL3644816, ZZMHVBPSRKMWLT-UHFFFAOYSA-N, KS-00000B2U, 6355AJ, FCH858048, MFCD08059080, ZINC62701890, AKOS006287617, 2-Hydroxy-4-methoxy-5-chlorobenzaldehyde, CJ-20923, DA-01593, NS-01690, SY026584, FT-0707774, Z-3665, MFCD08059080 (97+%), C8H7ClO3,

Complexity	162
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	186.008g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	186.591g/mol
Monoisotopic Mass	186.008g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	46.5A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.2

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319
Packing Group
Precautionary statements	P305+P351+P338
UN Code

Certificate of Analysis

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