AG0038D6

89793-12-4 | Ethyl 2-Chloropyrimidine-5-carboxylate

AG0038D6

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CAS Number	89793-12-4
Catalog Number	AG0038D6(AGN-PC-0N59GX)
Chemical Name	Ethyl 2-Chloropyrimidine-5-carboxylate
IUPAC Name	ethyl 2-chloropyrimidine-5-carboxylate
InChI	InChI=1S/C7H7ClN2O2/c1-2-12-6(11)5-3-9-7(8)10-4-5/h3-4H,2H2,1H3
InChI Key	IEMKQRSOAOPKRJ-UHFFFAOYSA-N
MDL Number	MFCD09863164
Molecular Formula	C7H7ClN2O2
Molecular Weight	186.5957
SMILES	ClC1=NC=C(C=N1)C(=O)OCC
Synonyms	Ethyl 2-chloropyrimidine-5-carboxylate, 89793-12-4, 2-Chloro-pyrimidine-5-carboxylic acid ethyl ester, 2-chloropyrimidine-5-carboxylic acid ethyl ester, MFCD09863164, ethyl-2-chloropyrimidine-5-carboxylate, Ethyl 2-chloro-pyrimidine-5-carboxylate, 5-Pyrimidinecarboxylic acid, 2-chloro-, ethyl ester, Ethyl 2-chloropyrimidine-5-carboxylate, 95%, Ethyl2-chloropyrimidine-5-carboxylate, ACMC-209r2w, KSC663I8R, SCHEMBL829286, CTK5G3488, DTXSID50440699, IEMKQRSOAOPKRJ-UHFFFAOYSA-N, ACT10943, BCP15035, KS-000002BT, ANW-39366, SBB090495, ZINC38950306, 2-Chloro-5-(ethoxycarbonyl)pyrimidine, AKOS006283037, AB53770, AS-5140, CS-W003995, RP24674, RP24677, AC-28079, AJ-97200, AK-32391, AN-35178, BC280175, BR-32391, CJ-19621, ethyl 2-chloranylpyrimidine-5-carboxylate, SC-21714, SY019435, AB0001605, DB-009963, ST1141074, TR-028170, 4CH-001389, AM20120297, BB 0260974, FT-0650141, W9257, MFCD09863164 (97%), C-2062, 2-chloro-5-pyrimidinecarboxylic acid ethyl ester, 793E124, A843313, 5-Pyrimidinecarboxylicacid, 2-chloro-, ethyl ester, J-520738, S03-0170, C7H7ClN2O2, ACN-040273, CID10487815, C2363, A10744, Ethyl 2-chloropyrimidine-5-carboxylate, 97% - 1G 1g, 17508-17-7,

Complexity	158
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	186.02g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	186.595g/mol
Monoisotopic Mass	186.02g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	52.1A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.5

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H332-H335
Packing Group
Precautionary statements	P261-P280-P305+P351+P338
UN Code

Certificate of Analysis

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