AG00CIRY

351457-86-8 | 5-BROMO-3-FORMYL-4-METHYLPYRIDINE

AG00CIRY

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CAS Number	351457-86-8
Catalog Number	AG00CIRY(AGN-PC-03MMPC)
Chemical Name	5-BROMO-3-FORMYL-4-METHYLPYRIDINE
IUPAC Name	5-bromo-4-methylpyridine-3-carbaldehyde
InChI	InChI=1S/C7H6BrNO/c1-5-6(4-10)2-9-3-7(5)8/h2-4H,1H3
InChI Key	VMKUWJPBSLTFMK-UHFFFAOYSA-N
MDL Number	MFCD09909851
Molecular Formula	C7H6BrNO
Molecular Weight	200.0326
SMILES	O=CC1=CN=CC(Br)=C1C
Synonyms	5-BROMO-4-METHYLNICOTINALDEHYDE, 351457-86-8, 5-Bromo-3-formyl-4-methylpyridine, 5-Bromo-4-methylpyridine-3-carbaldehyde, 5-Bromo-4-methyl-pyridine-3-carbaldehyde, SCHEMBL112640, CTK8B6636, DTXSID40623676, VMKUWJPBSLTFMK-UHFFFAOYSA-N, KS-00000OM6, ANW-53838, MFCD09909851, ZINC66054836, AKOS016000252, AN-2904, AK-48723, DS-14823, AB0042653, AJ-115715, TC-142583, ST24029403, Z0536, Q-7367, 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	1.4

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H317-H319
Packing Group
Precautionary statements	P280-P305+P351+P338
UN Code

Certificate of Analysis

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