AG001PEC

157335-93-8 | 5-Pyrimidinecarboxylic acid, 4,6-dimethyl-

AG001PEC

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CAS Number	157335-93-8
Catalog Number	AG001PEC(AGN-PC-0030HJ)
Chemical Name	5-Pyrimidinecarboxylic acid, 4,6-dimethyl-
IUPAC Name	4,6-dimethylpyrimidine-5-carboxylic acid
InChI	InChI=1S/C7H8N2O2/c1-4-6(7(10)11)5(2)9-3-8-4/h3H,1-2H3,(H,10,11)
InChI Key	SBJRXHBKPCHGQY-UHFFFAOYSA-N
MDL Number	MFCD07787545
Molecular Formula	C7H8N2O2
Molecular Weight	152.1506
SMILES	CC1=NC=NC(=C1C(=O)O)C
Synonyms	4,6-Dimethylpyrimidine-5-carboxylic acid, 157335-93-8, 5-Carboxy-4,6-dimethylpyrimidine, 4,6-Dimethyl-pyrimidine-5-carboxylic acid, 5-Pyrimidinecarboxylicacid, 4,6-dimethyl-, 4,6-DIMETHYL-5-PYRIMIDINECARBOXYLIC ACID, 4,6-dimethylpyrimidine-5-carboxylicacid, PubChem17096, 4, 6-dimethylpyrimidine-5-carboxylic acid, ACMC-1C27Q, SCHEMBL410293, Jsp003111, CTK0H4394, KS-00000IXC, DTXSID40565466, SBJRXHBKPCHGQY-UHFFFAOYSA-N, AC-372, ANW-21692, MFCD07787545, SBB053227, ZINC16124083, AKOS012039530, 5-Carboxy-4,6-dimethyl-1,3-diazine, AB42986, ACN-048993, CD-1028, HP21291, PS-5510, QC-1745, RL02024, VP50186, AJ-68272, AK-24036, AN-15912, BC221848, BR-24036, HC210329, 4,6-dimethyl 5-pyrimidine carboxylic acid, AB0000321, DB-025105, ST2410931, TC-067525, 4CH-009619, A3459, FT-0084061, FT-0650079, 5-pyrimidinecarboxylicacid,4,6-dimethyl-(9ci), B-2138, 4,6-dimethylpyrimidine-5-carboxylic acid ,98%, 335D938, 5-PYRIMIDINECARBOXYLIC ACID, 4,6-DIMETHYL-, S03-0130, W-201420, 4,6-dimethylpyrimidine-5-carboxylic acid, AldrichCPR, 5-carboxy-4,6-dimethylpyrimidine, 5-carboxy-4,6-dimethyl-1,3-diazine, C7H8N2O2, 5-Pyrimidinecarboxylic acid, 4,6-dimethyl- (9CI), 3-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)-pyridine, Propan-2-yl (E)-7-[(1R,2S,3R,5S)-3,5-dihydroxy-2-[(E)-3-hydroxy-4-[3-(trifluoromethyl)phenoxy]but-1-enyl]cyclopentyl]hept-5-enoate,

Complexity	151
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	152.059g/mol
Formal Charge	0
Heavy Atom Count	11
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	152.153g/mol
Monoisotopic Mass	152.059g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	63.1A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.5

GHS Hazard and Precautionary Statements

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

Certificate of Analysis

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