AG00DHUJ

56076-21-2 | 2-Ethoxy-5-fluoropyrimidin-4-amine

AG00DHUJ

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CAS Number	56076-21-2
Catalog Number	AG00DHUJ(AGN-PC-0SKA1I)
Chemical Name	2-Ethoxy-5-fluoropyrimidin-4-amine
EC Number	259-981-0
IUPAC Name	2-ethoxy-5-fluoropyrimidin-4-amine
InChI	InChI=1S/C6H8FN3O/c1-2-11-6-9-3-4(7)5(8)10-6/h3H,2H2,1H3,(H2,8,9,10)
InChI Key	UNPWKSQAHRVMMH-UHFFFAOYSA-N
MDL Number	MFCD18973123
Molecular Formula	C6H8FN3O
Molecular Weight	157.1456
SMILES	NC1=NC(OCC)=NC=C1F
Synonyms	2-Ethoxy-5-fluoropyrimidin-4-amine, 56076-21-2, 2-Ethoxy-5-fluoro-4-pyrimidinamine, EINECS 259-981-0, C6H8FN3O, 2-Ethoxy-5-fluoro-pyrimidin-4-ylamine, AC1L3N8A, AC1Q4O6B, SCHEMBL13530555, CTK5A4612, KS-00000RHE, DTXSID40204626, ZINC5863736, 4-Amino-2-Ethoxy5-fluoropyrimidine, MFCD18973123, 4-Pyrimidinamine,2-ethoxy-5-fluoro-, AKOS016845588, DS-2961, FS-3791, QC-7214, AJ-55114, AK132937, CJ-12786, AB0056523, ST2416849, 4CH-003135, Z4887, M-8862, C6-H8-F-N3-O, CID92005, AR-1E1294, 576-59-0,

Complexity	124
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	157.065g/mol
Formal Charge	0
Heavy Atom Count	11
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	157.148g/mol
Monoisotopic Mass	157.065g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	61A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.6

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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