AG003MH6

5034-74-2 | 5-Bromo-2-hydroxy-3-methoxybenzaldehyde

AG003MH6

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CAS Number	5034-74-2
Catalog Number	AG003MH6(AGN-PC-0JNX5O)
Chemical Name	5-Bromo-2-hydroxy-3-methoxybenzaldehyde
IUPAC Name	5-bromo-2-hydroxy-3-methoxybenzaldehyde
InChI	InChI=1S/C8H7BrO3/c1-12-7-3-6(9)2-5(4-10)8(7)11/h2-4,11H,1H3
InChI Key	MMFKBTPDEVLIOR-UHFFFAOYSA-N
MDL Number	MFCD00016593
Molecular Formula	C8H7BrO3
Molecular Weight	231.0434
NSC Number	95683
SMILES	O=CC1=CC(Br)=CC(OC)=C1O
Synonyms	5-bromo-2-hydroxy-3-methoxybenzaldehyde, 5-Bromo-2-hydroxy-3-methoxybenzaldehyde, 5034-74-2, 5-Bromo-3-methoxysalicylaldehyde, Benzaldehyde, 5-bromo-2-hydroxy-3-methoxy-, MMFKBTPDEVLIOR-UHFFFAOYSA-N, MFCD00016593, 5-Bromo-2-Vanillin, NSC95683, ACMC-20am5q, NCIOpen2_006032, SCHEMBL294053, AC1L671R, AC1Q25O7, AC1Q484B, CHEMBL3660317, 3-methoxy-5-bromosalicylaldehyde, CTK4J2482, KS-00000URY, ZINC56914, DTXSID10294271, BDBM110980, BBL023438, NSC-95683, SBB016357, STK096398, AKOS000112408, CS-W010368, MCULE-7989072831, RP05542, TRA0050712, 5bromo-2-hydroxy-3-methoxy-benzaldehyde, 5-Bromo-2-hydroxy-3-methoxy-benzaldehyde, AJ-09499, AK140087, BP-20021, SC-69637, ZB001883, AB0006634, Benzaldehyde,5-bromo-2-hydroxy-3-methoxy-, DB-051758, TC-168389, FT-0620094, ST45144076, T7897, Y9252, 5-Bromo-2-hydroxy-3-methoxybenzaldehyde, 97%, 10P-921, 156233-EP2272817A1, 156233-EP2284169A1, 156233-EP2287161A1, 156233-EP2287162A1, AE-848/30539041, J-516939, US8614253, .3-11, F3099-6630, I14-111148, InChI=1/C8H7BrO3/c1-12-7-3-6(9)2-5(4-10)8(7)11/h2-4,11H,1H, C8H7BrO3, AR-1G7396, CID262238, 5071-61-4,

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	2.1

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

Certificate of Analysis

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