AG00IJYC

975-17-7 | 3H-Xanthen-3-one, 2,6,7-trihydroxy-9-phenyl-

AG00IJYC

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CAS Number	975-17-7
Catalog Number	AG00IJYC(AGN-PC-0JL9OL)
Chemical Name	3H-Xanthen-3-one, 2,6,7-trihydroxy-9-phenyl-
EC Number	213-550-3
IUPAC Name	2,6,7-trihydroxy-9-phenylxanthen-3-one
InChI	InChI=1S/C19H12O5/c20-13-6-11-17(8-15(13)22)24-18-9-16(23)14(21)7-12(18)19(11)10-4-2-1-3-5-10/h1-9,20-22H
InChI Key	YDCFOUBAMGLLKA-UHFFFAOYSA-N
MDL Number	MFCD00005048
Molecular Formula	C19H12O5
Molecular Weight	320.2956
SMILES	OC1=CC2=C(C3=CC(=C(C=C3OC2=CC1=O)O)O)C1=CC=CC=C1
UNII	73861AE9L7
Synonyms	fluorone Black, m-nitrophenylfluorone, phenylfluorone, trimethoxyphenlyfluorone, Fluorone black, 975-17-7, Phenylfluorone, 9-Phenyl-2,3,7-trihydroxy-6-fluorone, Fluorone, phenyl-, 2,6,7-Trihydroxy-9-phenyl-3H-xanthen-3-one, 2,6,7-Trihydroxy-9-phenylxanthen-3-one, 9-pheny-3-fluorone, 3H-Xanthen-3-one, 2,6,7-trihydroxy-9-phenyl-, UNII-73861AE9L7, 9-Phenyl-3-fluorone, 2,3,7-Trihydroxy-9-phenyl-6-fluorone, CHEMBL375328, NSC2608, C19H12O5, MFCD00005048, 73861AE9L7, 2,6,7-Trihydroxy-9-phenyl-3-isoxanthone, 2,6,7-trihydroxy-9-phenyl-xanthen-3-one, 2,6,7-Trihydroxy-9-phenylisoxanthene-3-one, 2,6,7-Trihydroxy-9-phenyl-isoxanthen-3-one, 2,7-Trihydroxy-9-phenyl-6-fluorone, 9-Phenyl-2,7-trihydroxy-6-fluorone, 3H-Xanthen-3-one,6,7-trihydroxy-9-phenyl-, phenylfluoron, NSC 2608, EINECS 213-550-3, NSC 66463, 9-PhFl, AI3-63041, Chembridge 5108509, CBChromo1_000049, AC1L2E1Z, AC1Q69RR, CBDivE_003845, CBDivE_004001, labotest-bb lt00053733, cid_70420, SCHEMBL2860609, DTXSID2061355, YDCFOUBAMGLLKA-UHFFFAOYSA-N, NSC-2608, NSC66463, ZINC3860685, BDBM50206442, NSC-66463, SBB056803, STK003215, AKOS000520600, MCULE-3716942314, NE10373, 9-Phenyl-2,3-7-trihydroxy-6-fluorone, AN-22286, TG2-222-7, 2,6,7-Trihydroxy-9-phenylisoxanthen-3-one, FT-0621686, ST50307979, X6793, 2,6,7-trihydroxy-9-phenyl-3h-xanthen-3-on, 2,6,7-Trihydroxy-9-phenyl-3H-xanthen-3-one #, SR-01000404013, SR-01000404013-1, I14-20058, Phenyl Fluorone 98.5% AR 1gm, CID70420, AR-1H5987, C19-H12-O5, T0450, 9-cyclohexyl-2,6,7-trihydroxy-1,2,4,4a,5,6,7,8,8a,9,9a,10a-dodecahydroxanthen-3-one, 5415-06-5,

Complexity	638
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	320.068g/mol
Formal Charge	0
Heavy Atom Count	24
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	3
Isotope Atom Count	0
Molecular Weight	320.3g/mol
Monoisotopic Mass	320.068g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	87A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.4

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H335
Packing Group
Precautionary statements	P261-P280-P301+P312-P302+P352-P305+P351+P338
UN Code

Certificate of Analysis

Lot Number