AG003MH7

57543-36-9 | 5-Bromo-2-hydroxy-4-methoxybenzaldehyde

AG003MH7

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CAS Number	57543-36-9
Catalog Number	AG003MH7(AGN-PC-0JWIFH)
Chemical Name	5-Bromo-2-hydroxy-4-methoxybenzaldehyde
IUPAC Name	5-bromo-2-hydroxy-4-methoxybenzaldehyde
InChI	InChI=1S/C8H7BrO3/c1-12-8-3-7(11)5(4-10)2-6(8)9/h2-4,11H,1H3
InChI Key	OHSSWZLKWHLYFP-UHFFFAOYSA-N
MDL Number	MFCD00839421
Molecular Formula	C8H7BrO3
Molecular Weight	231.0434
SMILES	O=CC1=CC(Br)=C(OC)C=C1O
Synonyms	5-bromo-2-hydroxy-4-methoxybenzaldehyde, 57543-36-9, 5-Bromo-2-hydroxy-4-methoxy-benzaldehyde, Benzaldehyde, 5-bromo-2-hydroxy-4-methoxy-, 3-bromo-6-hydroxy-4-methoxy-benzaldehyde, AE-848/30539042, AC1LGAM3, SCHEMBL5490218, CTK1F1788, DTXSID80355904, OHSSWZLKWHLYFP-UHFFFAOYSA-N, ZINC332717, KS-00000B2E, 6339AJ, MFCD00839421, SBB097692, AKOS024258098, FCH1332076, OR52694, 2-Hydroxy-4-methoxy-5-bromobenzaldehyde, AK187597, AS-38414, CJ-02853, SY025558, ZB010662, AX8266951, FT-0761984, Z-3592, MFCD00839421 (95+%), 5-Bromo-2-hydroxy-4-methoxy-benzaldehyde, AldrichCPR, C8H7BrO3, CID818108, ZINC00332717,

Complexity	162
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	229.958g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	231.045g/mol
Monoisotopic Mass	229.958g/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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