AG00DKEN

4558-59-2 | 4,6-diMethoxypyriMidine-5-carbaldehyde

AG00DKEN

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CAS Number	4558-59-2
Catalog Number	AG00DKEN(AGN-PC-0LB3LI)
Chemical Name	4,6-diMethoxypyriMidine-5-carbaldehyde
IUPAC Name	4,6-dimethoxypyrimidine-5-carbaldehyde
InChI	InChI=1S/C7H8N2O3/c1-11-6-5(3-10)7(12-2)9-4-8-6/h3-4H,1-2H3
InChI Key	WQGFZQFGVYDFOP-UHFFFAOYSA-N
MDL Number	MFCD01912557
Molecular Formula	C7H8N2O3
Molecular Weight	168.1500
SMILES	O=CC1=C(OC)N=CN=C1OC
Synonyms	4,6-dimethoxypyrimidine-5-carbaldehyde, 4558-59-2, AC1NB2QX, AC1Q4FBU, SCHEMBL1478136, CTK7B2183, 4,6-Dimethoxy-5-formylpyrimidin, DTXSID40403278, WQGFZQFGVYDFOP-UHFFFAOYSA-N, 4,6-dimethoxypyrimidin-5-aldehyde, 4,6-dimethoxypyrimidine-5-aldehyde, KS-00000R8V, ZINC5720081, 4,6-dimethoxypyrimidin- 5-aldehyde, 6282AB, MFCD01912557, STK946098, AKOS001445277, CM10699, MCULE-4507586374, NE22178, 4,6-dimethoxypyrimidine-5-carboaldehyde, AJ-54620, AK-47080, DS-14202, ST2405271, 4CH-017518, EN300-41271, 4,6-DIMETHOXY-5-PYRIMIDINECARBALDEHYDE, F0704-0012, C7H8N2O3, ZINC05720081, CID4436645,

Complexity	142
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	168.053g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	168.152g/mol
Monoisotopic Mass	168.053g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	61.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.3

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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