AG00948O

1087659-24-2 | 5-Bromo-3-methoxypicolinaldehyde

AG00948O

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CAS Number	1087659-24-2
Catalog Number	AG00948O(AGN-PC-07CGI9)
Chemical Name	5-Bromo-3-methoxypicolinaldehyde
IUPAC Name	5-bromo-3-methoxypyridine-2-carbaldehyde
InChI	InChI=1S/C7H6BrNO2/c1-11-7-2-5(8)3-9-6(7)4-10/h2-4H,1H3
InChI Key	WJFAWSUSKWTMSS-UHFFFAOYSA-N
MDL Number	MFCD11857632
Molecular Formula	C7H6BrNO2
Molecular Weight	216.0320
SMILES	O=CC1=NC=C(Br)C=C1OC
Synonyms	5-Bromo-3-methoxypicolinaldehyde, 1087659-24-2, 5-bromo-3-methoxypyridine-2-carbaldehyde, SCHEMBL17161019, CTK6J5112, DTXSID40670140, AC1Q4850, ACMC-209918, KS-00000J5K, ANW-15978, MFCD11857632, ZINC35270359, AKOS015835357, DS-7615, RTR-057489, AJ-91121, CJ-18704, 5-Bromo-3-methoxypyridine-2-carboxaldehyde, TR-057489, FT-0678839, Z7234, 5-Bromo-3-methoxypicolinaldehyde, AldrichCPR, A-5930, I14-26085, C7H6BrNO2,

Complexity	142
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	214.958g/mol
Formal Charge	0
Heavy Atom Count	11
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	216.034g/mol
Monoisotopic Mass	214.958g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	39.2A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.3

GHS Hazard and Precautionary Statements

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

Certificate of Analysis

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