AG003MEI

7164-43-4 | 5-Amino-2,6-dioxo-1,2,3,6-tetrahydropyrimidine-4-carboxylic acid

AG003MEI

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CAS Number	7164-43-4
Catalog Number	AG003MEI(AGN-PC-0JLAX8)
Chemical Name	5-Amino-2,6-dioxo-1,2,3,6-tetrahydropyrimidine-4-carboxylic acid
EC Number	230-514-2
IUPAC Name	5-amino-2,4-dioxo-1H-pyrimidine-6-carboxylic acid
InChI	InChI=1S/C5H5N3O4/c6-1-2(4(10)11)7-5(12)8-3(1)9/h6H2,(H,10,11)(H2,7,8,9,12)
InChI Key	HWCXJKLFOSBVLH-UHFFFAOYSA-N
MDL Number	MFCD00010563
Molecular Formula	C5H5N3O4
Molecular Weight	171.1109
NSC Number	43249
SMILES	NC1=C(NC(=O)NC1=O)C(O)=O
UNII	UM0F8VQR7M
Synonyms	5-aminoorotic acid, 5-Aminoorotic acid, 7164-43-4, 5-amino-2,6-dioxo-1,2,3,6-tetrahydropyrimidine-4-carboxylic acid, Orotic acid, 5-amino-, Orothic acid, 5-amino-, 4-Pyrimidinecarboxylic acid, 5-amino-1,2,3,6-tetrahydro-2,6-dioxo-, 5-amino-2,6-dihydroxypyrimidine-4-carboxylic acid, EINECS 230-514-2, UNII-UM0F8VQR7M, NSC 43249, UM0F8VQR7M, HWCXJKLFOSBVLH-UHFFFAOYSA-N, 5-Amino-2,6-dioxo-1,2,3,4-tetrahydropyrimidine-4-carboxylic acid, 5-amino-2,4-dioxo-1H-pyrimidine-6-carboxylic acid, 5-amino-2,6-dioxo-1,3-dihydropyrimidine-4-carboxylic acid, Amino orotic acid, 6311-72-4, 5-amino-orotic acid, PubChem22157, AC1Q5RBS, AC1L2J4K, 5-Aminoorotic acid, 99%, SCHEMBL190140, CHEMBL1615017, DTXSID1064582, 5-Aminouracil-6-carboxylic Acid, CTK5B7623, CTK7H0030, KS-00000JNE, Orotic acid, 5-amino- (VAN), ALBB-023348, NSC43249, ZINC1861052, ANW-54413, BBL012268, BBL027999, HTS001346, MFCD00010563, NSC-43249, SBB003848, STK801850, STK803136, AKOS000119771, AKOS005622613, BS-3932, MCULE-8801103464, Orotic acid, 5-amino- (VAN) (8CI), AC-10135, AJ-32140, AK-89041, LS-98416, SC-52947, 5-Amino-6-carboxy-2,4-dihydroxypyrimidine, A0947, BB 0242394, FT-0620024, R1220, V0689, A837272, SR-01000529572, 5-amino-2,4-dihydroxy-pyrimidine-6-carboxylic acid, I14-7634, SR-01000529572-1, 4-Pyrimidinecarboxylic acid, 5-amino-2,6-dihydroxy-, 5-azanyl-2,4-bis(oxidanylidene)-1H-pyrimidine-6-carboxylic acid, 5-Amino-2,6-dioxo-1,2,3,6-tetrahydro-pyrimi dine-4-carboxylic acid, IJZ, C5H5N3O4, C5-H5-N3-O4, CID73018, AR-1G7065, 5-Aminoorotic acid, 98% - 25G 25g, 4-Pyrimidinecarboxylic acid,2,3,6-tetrahydro-2,6-dioxo-, 63979-37-3,

Complexity	306
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	171.028g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	4
Isotope Atom Count	0
Molecular Weight	171.112g/mol
Monoisotopic Mass	171.028g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	122A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	-1.2

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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