AG00BZD7

3709-98-6 | 2-Ethyl-6-hydroxypyrimidin-4(3h)-one

AG00BZD7

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CAS Number	3709-98-6
Catalog Number	AG00BZD7(AGN-PC-0O9EUX)
Chemical Name	2-Ethyl-6-hydroxypyrimidin-4(3h)-one
IUPAC Name	2-ethyl-4-hydroxy-1H-pyrimidin-6-one
InChI	InChI=1S/C6H8N2O2/c1-2-4-7-5(9)3-6(10)8-4/h3H,2H2,1H3,(H2,7,8,9,10)
InChI Key	CBXPKEZRCKCOID-UHFFFAOYSA-N
MDL Number	MFCD09907955
Molecular Formula	C6H8N2O2
Molecular Weight	140.1399
SMILES	CCC1=NC(O)=CC(O)=N1
Synonyms	2-Ethyl-4,6-dihydroxypyrimidine, 3709-98-6, 2-Ethyl-6-hydroxypyrimidin-4(1H)-one, 2-ethyl-6-hydroxypyrimidin-4(3H)-one, 4(1H)-Pyrimidinone, 2-ethyl-6-hydroxy- (9CI), 2-Ethyl-6-hydroxy-4(3H)-pyrimidinone, AK-27707, AC1LAURK, 2-ethyl-4,6-pyrimidinediol, 2-ethylpyrimidine-4,6-diol, 2-Ethyl-pyrimidine-4,6-diol, 4,6-dihydroxy-2ethylpyrimidine, SCHEMBL10004688, 4,6-dihydroxy-2-ethylpyrimidine, CTK6D2652, CTK8I4591, DTXSID00334473, CBXPKEZRCKCOID-UHFFFAOYSA-N, ALBB-014912, ANW-57371, MFCD09907955, ZINC32152830, AKOS005174612, AKOS015838569, ACM3709986, AM81338, MP-1792, 2-ethyl-4-hydroxy-1H-pyrimidin-6-one, 2-ethyl-6-hydroxy-3H-pyrimidin-4-one, CJ-17888, DS-10890, 4(3H)-pyrimidinone, 2-ethyl-6-hydroxy-, AB0054400, AX8089491, DB-021038, ST2416857, TR-015108, 4CH-015657, FT-0646157, T1532, Z4666, 2-ethyl-6-hydroxy-3,4-dihydropyrimidin-4-one, 4(1H)-Pyrimidinone,2-ethyl-6-hydroxy-(9ci), C6H8N2O2, CID520836, 4 -Pyrimidinone,2-ethyl-6-hydroxy-,

Complexity	218
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	140.059g/mol
Formal Charge	0
Heavy Atom Count	10
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	140.142g/mol
Monoisotopic Mass	140.059g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	61.7A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	-0.4

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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