AG0048JQ

885167-81-7 | 6-Bromo-5-methylnicotinaldehyde

AG0048JQ

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CAS Number	885167-81-7
Catalog Number	AG0048JQ(AGN-PC-078JP4)
Chemical Name	6-Bromo-5-methylnicotinaldehyde
IUPAC Name	6-bromo-5-methylpyridine-3-carbaldehyde
InChI	InChI=1S/C7H6BrNO/c1-5-2-6(4-10)3-9-7(5)8/h2-4H,1H3
InChI Key	GLUTVVKVSPUTKQ-UHFFFAOYSA-N
MDL Number	MFCD08277302
Molecular Formula	C7H6BrNO
Molecular Weight	200.0326
SMILES	O=CC1=CN=C(Br)C(C)=C1
Synonyms	6-bromo-5-methylnicotinaldehyde, 885167-81-7, 2-Bromo-5-formyl-3-methylpyridine, 6-BROMO-5-METHYLPYRIDINE-3-CARBALDEHYDE, AK-62075, 3-PYRIDINECARBOXALDEHYDE, 6-BROMO-5-METHYL-, PubChem19576, SCHEMBL4596581, CTK8B4301, DTXSID90660571, GLUTVVKVSPUTKQ-UHFFFAOYSA-N, 6-bromo-5-methyl nicotine aldehyde, ANW-44639, MFCD08277302, ZINC15684469, 2-BROMO-5-FORMYL-3-PICOLINE, AKOS005264167, AB44906, FCH1324456, VP10087, KS-00000P44, AJ-67790, BC004453, DS-14912, EN000650, 6-Bromo-5-methylpyridine-3-carboxaldehyde, AX8217834, TC-133384, FT-0692850, ST24024299, Z0993, Q-7368, 6-BROMO-5-METHYL-3-PYRIDINECARBOXALDEHYDE, I02-2371, C7H6BrNO,

Complexity	129
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	198.963g/mol
Formal Charge	0
Heavy Atom Count	10
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	200.035g/mol
Monoisotopic Mass	198.963g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	30A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.7

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302
Packing Group
Precautionary statements	P280-P305+P351+P338
UN Code

Certificate of Analysis

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