AG003447

3368-04-5 | 4-Methyl-2-oxo-2H-chromen-7-yl dihydrogen phosphate

AG003447

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CAS Number	3368-04-5
Catalog Number	AG003447(AGN-PC-0JL6K8)
Chemical Name	4-Methyl-2-oxo-2H-chromen-7-yl dihydrogen phosphate
EC Number	222-137-7
IUPAC Name	(4-methyl-2-oxochromen-7-yl) dihydrogen phosphate
InChI	InChI=1S/C10H9O6P/c1-6-4-10(11)15-9-5-7(2-3-8(6)9)16-17(12,13)14/h2-5H,1H3,(H2,12,13,14)
InChI Key	BCHIXGBGRHLSBE-UHFFFAOYSA-N
MDL Number	MFCD00016969
Molecular Formula	C10H9O6P
Molecular Weight	256.1486
SMILES	P(=O)(OC1=CC=C2C(=CC(OC2=C1)=O)C)(O)O
Synonyms	4-methylumbelliferyl phosphate, 4-Methylumbelliferyl phosphate, 3368-04-5, 4-Methyl-2-oxo-2H-chromen-7-yl dihydrogen phosphate, 4-MUP, Phosphoric Acid 4-Methylumbelliferyl Ester, 2H-1-Benzopyran-2-one, 4-methyl-7-(phosphonooxy)-, 4-Methylumbelliferylphosphate, Free Acid, M-5800, (4-methyl-2-oxochromen-7-yl) dihydrogen phosphate, 5,5-dinitrobarbutyric acid, AC1L22MS, SCHEMBL140039, 4-methylumbelliferone phosphate, C10H9O6P, CHEMBL255305, DTXSID8062995, CTK7H2453, BIM2047, BCHIXGBGRHLSBE-UHFFFAOYSA-N, ZX-AFC000317, HY-D0994, KS-00000Y1X, ZINC1895413, ZX-AT023980, EINECS 222-137-7, MFCD00016969, AKOS015899733, CS-8089, VZ29447, 4-Methylumbelliferyl phosphate free acid, 4-Methylumbelliferyl phosphate, free acid, AJ-32225, AK117682, 4-Methylumbelliferyl phosphate (free acid), TR-038701, FT-0619125, FT-0619126, P1060, W0285, A-8677, (4-methyl-2-oxochromen-7-yl)oxyphosphonic acid, C-57564, 2H-1-Benzopyran-2-one,4-methyl-7-(phosphonooxy)-, 4-Methylumbelliferyl phosphate, phosphatase substrate, 4-Methyl-2-oxo-2H-1-benzopyran-7-ylphosphonic acid, I14-11555, 4-Methylumbelliferyl phosphate (4-MUP) Liquid Substrate System, liquid, KLV, 4-METHYLUMBELLIFERYLPHOSPHATE, CID65118, 4-Methylumbelliferyl phosphate, 99% - 1G 1g, M-5801, C005359,

Complexity	398
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	256.014g/mol
Formal Charge	0
Heavy Atom Count	17
Hydrogen Bond Acceptor Count	6
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	256.15g/mol
Monoisotopic Mass	256.014g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	93.1A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.6

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	8
Hazard statements	H315-H319-H335
Packing Group	Ⅱ
Precautionary statements	P261-P305+P351+P338
UN Code	UN 1760

Certificate of Analysis

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