AG00BBOY

220141-70-8 | 5-FLUOROOROTIC ACID HYDRATE 98

AG00BBOY

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CAS Number	220141-70-8
Catalog Number	AG00BBOY(AGN-PC-0WABEE)
Chemical Name	5-FLUOROOROTIC ACID HYDRATE 98
IUPAC Name	5-fluoro-2,4-dioxo-1H-pyrimidine-6-carboxylic acid;hydrate
InChI	InChI=1S/C5H3FN2O4.H2O/c6-1-2(4(10)11)7-5(12)8-3(1)9;/h(H,10,11)(H2,7,8,9,12);1H2
InChI Key	LODRRYMGPWQCTR-UHFFFAOYSA-N
MDL Number	MFCD00042526
Molecular Formula	C5H5FN2O5
Molecular Weight	192.1020
SMILES	O=C(C(NC1=O)=C(F)C(N1)=O)O.[H]O[H]
Synonyms	220141-70-8, 5-fluoro-2,6-dioxo-1,2,3,6-tetrahydropyrimidine-4-carboxylic acid hydrate, 5-Fluoroorotic acid monohydrate, 5-Fluoroorotic acid hydrate, 207291-81-4, 5-Fluoroorotic Acid,Monohydrate, MFCD00150658, 5-FLUOROOROTIC ACID HYDRATE 98, 5-Fluorouracil-6-carboxylic acid monohydrate, 5-Fluoro-1,2,3,6-tetrahydro-2,6-dioxopyrimidine-4-carboxylic acid hydrate, C5H5FN2O5, W-206549, 5-fluoroortic acid monohydrate, SCHEMBL147605, 5-fluororotic acid monohydrate, 5-fluoro-orotic acid monohydrate, 5-fluoroorotic acid mono hydrate, CTK1A0156, KS-00002AVG, LODRRYMGPWQCTR-UHFFFAOYSA-N, 5-Fluoroorotic acid hydrate, 95%, ZX-AP004514, PC4054, SBB091366, 5-Fluoroorotic acid hydrate, >=98%, AKOS015893281, DS-2998, PS-8347, RP03830, ACM207291814, ACM220141708, AK138858, SY040026, AB0040570, AB1010891, AX8260470, TL8004968, 5-Fluorouracil-4-carboxylic acid monohydrate, FT-0676419, Y8197, Z4423, MFCD00150658 (96%), C-5121, 5-Fluoroorotic acid hydrate, >=99.0% (TLC), 703-95-7(anhydrous) 220141-70-8, A836869, I04-5649, J-014424, 5-fluoro-2,4-dioxo-1H-pyrimidine-6-carboxylic acid hydrate, 2,6-Dihydroxy-5-fluoropyrimidine-4-carboxylic acid monohydrate, 5-fluoranyl-2,4-bis(oxidanylidene)-1H-pyrimidine-6-carboxylic acid hydrate, 5-fluoro-2,6-dioxo-1,3-dihydropyrimidine-4-carboxylic acid, hydrate, 4-Pyrimidinecarboxylicacid, 5-fluoro-1,2,3,6-tetrahydro-2,6-dioxo-, hydrate (1:1), Not Available, 5-FOA, 5-Fluoroorotic acid, monohydrate, 5-FLUOROOROTICACIDHYDRATE,98, 703-95-7,

Complexity	309
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	2
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	192.018g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	6
Hydrogen Bond Donor Count	4
Isotope Atom Count	0
Molecular Weight	192.102g/mol
Monoisotopic Mass	192.018g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	96.5A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0

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

Lot Number