AG003N14

529-84-0 | 6,7-Dihydroxy-4-methyl-2H-chromen-2-one

AG003N14

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CAS Number	529-84-0
Catalog Number	AG003N14(AGN-PC-0LPZH2)
Chemical Name	6,7-Dihydroxy-4-methyl-2H-chromen-2-one
EC Number	208-470-0
IUPAC Name	6,7-dihydroxy-4-methylchromen-2-one
InChI	InChI=1S/C10H8O4/c1-5-2-10(13)14-9-4-8(12)7(11)3-6(5)9/h2-4,11-12H,1H3
InChI Key	KVOJTUXGYQVLAJ-UHFFFAOYSA-N
MDL Number	MFCD00006859
Molecular Formula	C10H8O4
Molecular Weight	192.1681
SMILES	CC1=CC(=O)OC2=CC(O)=C(O)C=C12
UNII	132H8N0A91
Synonyms	6,7-dihydroxy-4-methylcoumarin, DHMC-6,7, 4-Methylesculetin, 529-84-0, 6,7-DIHYDROXY-4-METHYLCOUMARIN, 6,7-Dihydroxy-4-methyl-2H-chromen-2-one, Methylesculetin, 4-Methylaesculetin, 4-Methylesculetol, 4-Methyl-6,7-dihydroxycoumarin, 2H-1-Benzopyran-2-one, 6,7-dihydroxy-4-methyl-, Coumarin, 6,7-dihydroxy-4-methyl-, 6,7-Dihydroxy-4-methyl-2H-benzopyran-2-one, NSC 11828, 6,7-dihydroxy-4-methylchromen-2-one, NSC 688807, UNII-132H8N0A91, EINECS 208-470-0, 6,7-Dihydroxy-4-methyl-chromen-2-one, BRN 0162550, AI3-18220, CHEMBL313244, KVOJTUXGYQVLAJ-UHFFFAOYSA-N, 6,7-Dihydroxy-4-methyl-2H-1-benzopyran-2-one, NSC11828, MFCD00006859, NSC688807, 132H8N0A91, NSC-688807, SR-01000389898, Spectrum_001029, SpecPlus_000495, Spectrum2_000617, Spectrum3_000592, Spectrum4_001864, Spectrum5_000428, AC1NSY77, Oprea1_739367, BSPBio_002064, KBioGR_002330, KBioSS_001509, 5-18-03-00231 (Beilstein Handbook Reference), DivK1c_006591, SCHEMBL409482, SPECTRUM1500729, SPBio_000554, DTXSID6060187, 4-methy1-6,7-dihydroxycoumarin, KBio1_001535, KBio2_001509, KBio2_004077, KBio2_006645, KBio3_001564, ZINC58125, ALBB-015650, KS-000013XH, 7498AB, ANW-43466, BBL027618, BDBM50078820, CCG-38534, CM-899, NSC-11828, SBB057778, STL372185, AKOS003241110, GS-5460, MCULE-2984770490, SDCCGMLS-0066617.P001, NCGC00095628-01, NCGC00095628-02, NCGC00178836-01, AJ-09814, AN-45606, LS-55168, ZB002326, 4-methyl-6,7-bis(oxidanyl)chromen-2-one, TR-037421, 6,7-dihydroxy-4-methyl-1-benzopyran-2-one, EU-0066858, FT-0619082, M0766, R1156, ST45024832, A829333, I14-1655, SR-01000389898-1, SR-01000389898-2, W-200029, F1011-0383, InChI=1/C10H8O4/c1-5-2-10(13)14-9-4-8(12)7(11)3-6(5)9/h2-4,11-12H,1H, Coumarin,7-dihydroxy-4-methyl-, C10H8O4, C10-H8-O4, ACN-056956, CID5319502, 2H-1-Benzopyran-2-one,7-dihydroxy-4-methyl-, C570020, 5,6,7,7a,8,9,10,11-Octahydro-4H-benzo[ef]heptalene, 65875-05-0,

Complexity	284
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	192.042g/mol
Formal Charge	0
Heavy Atom Count	14
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	192.17g/mol
Monoisotopic Mass	192.042g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	66.8A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.5

GHS Hazard and Precautionary Statements

Symbol:
Hazard statements	H315-H319-H335
Precuationary statements	P261-P280-P305+P351+P338-P304+P340-P405-P501
Siginal words

Certificate of Analysis

Lot Number