AG00ECGA

623585-74-0 | Methyl 2,5-dichloroisonicotinate

AG00ECGA

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CAS Number	623585-74-0
Catalog Number	AG00ECGA(AGN-PC-0559QB)
Chemical Name	Methyl 2,5-dichloroisonicotinate
IUPAC Name	methyl 2,5-dichloropyridine-4-carboxylate
InChI	InChI=1S/C7H5Cl2NO2/c1-12-7(11)4-2-6(9)10-3-5(4)8/h2-3H,1H3
InChI Key	OJTXNNHRMCEWAM-UHFFFAOYSA-N
MDL Number	MFCD09951944
Molecular Formula	C7H5Cl2NO2
Molecular Weight	206.0261
SMILES	O=C(OC)C1=C(Cl)C=NC(Cl)=C1
Synonyms	methyl 2,5-dichloroisonicotinate, 623585-74-0, methyl 2,5-dichloropyridine-4-carboxylate, 4-Pyridinecarboxylic acid, 2,5-dichloro-, methyl ester, SCHEMBL236107, CTK5B4951, KS-00000ITX, DTXSID10649782, OJTXNNHRMCEWAM-UHFFFAOYSA-N, CS-D0482, MFCD09951944, SBB093571, ZINC14007560, AKOS005073604, MB-0729, MCULE-4877566347, RP11993, RTR-021446, SB21125, AJ-64652, AK126033, SC-34594, SY035621, 2,5-dichloroisonicotinic acid methyl ester, DB-023469, TR-021446, FT-0681216, ST24047581, Z0736, MFCD09951944 (95%), Q-7979, J-521896, I14-28598, C7H5Cl2NO2, Methyl2,5-dichloroisonicotinate, ACN-043556,

Complexity	177
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	204.97g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	206.022g/mol
Monoisotopic Mass	204.97g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	39.2A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.3

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

Certificate of Analysis

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