AG002KXN

2107-76-8 | 2H-1-Benzopyran-2-one, 5,7-dihydroxy-4-methyl-

AG002KXN

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CAS Number	2107-76-8
Catalog Number	AG002KXN(AGN-PC-0LQB00)
Chemical Name	2H-1-Benzopyran-2-one, 5,7-dihydroxy-4-methyl-
EC Number	218-289-9
IUPAC Name	5,7-dihydroxy-4-methylchromen-2-one
InChI	InChI=1S/C10H8O4/c1-5-2-9(13)14-8-4-6(11)3-7(12)10(5)8/h2-4,11-12H,1H3
InChI Key	QNVWGEJMXOQQPM-UHFFFAOYSA-N
MDL Number	MFCD00016966
Molecular Formula	C10H8O4
Molecular Weight	192.1681
NSC Number	5302
SMILES	OC1=C2C(=CC(OC2=CC(=C1)O)=O)C
UNII	VP62D4346M
Synonyms	5,7-DHMC, 5,7-dihydroxy-4-methylcoumarin, 5,7-DIHYDROXY-4-METHYLCOUMARIN, 2107-76-8, 5,7-Dihydroxy-4-methyl-2H-chromen-2-one, 4-Methyllimetol, 4-Methyl-5,7-dihydroxycoumarin, 2H-1-Benzopyran-2-one, 5,7-dihydroxy-4-methyl-, 5,7-dihydroxy-4-methylchromen-2-one, 5,7-Dihydroxy-4-methyl-2H-1-benzopyran-2-one, Coumarin, 5,7-dihydroxy-4-methyl-, MFCD00016966, 5,7-Dihydroxy-4-methyl-chromen-2-one, CHEMBL12252, UNII-VP62D4346M, CCRIS 5908, HSDB 4277, 4-methyl-5,7-dihydroxy-coumarin, NSC5302, QNVWGEJMXOQQPM-UHFFFAOYSA-N, VP62D4346M, NSC 5302, EINECS 218-289-9, 5,7-Dihydroxy-4-methyl-2-benzopyrone, AI3-23192, 5,7-Dihydroxy-4-methyl-2-chromenone, SpecPlus_000809, Coumarin derivative, 1b, AC1NS5AY, Maybridge1_004060, Spectrum2_001356, DSSTox_CID_5078, ACMC-20am75, DSSTox_RID_77654, DSSTox_GSID_25078, Oprea1_360904, MLS002207303, DivK1c_006905, SCHEMBL403833, SPBio_001571, DTXSID0025078, CTK4E5820, KBio1_001849, ZINC58126, ACT08216, ALBB-015749, NSC-5302, Tox21_200882, BBL027825, BDBM50022180, CCG-39294, LS-999, STL372635, AKOS005175144, AM84731, MCULE-2069759263, 5,7-Dihydroxy-4-methylcoumarin, 98%, KS-000018X3, NCGC00091651-01, NCGC00091651-02, NCGC00258436-01, AJ-09815, AN-50398, AS-37776, SMR001306810, ZB002327, CAS-2107-76-8, TC-020139, A4571, D4747, EU-0034205, FT-0082741, FT-0602236, ST50308913, 5,7-Dihydroxy-4-methyl-2H-chromen-2-one #, K-6071, 2H-1-Benzopyran-2-one,5,7-dihydroxy-4-methyl-, 2H-1-Benzopyran-2-one, 5, 7-dihydroxy-4-methyl-, J-013822, BRD-K17275330-001-03-9, I14-30873, Methyl-2H-Chromen-2-One; 4-Methyl-5,7-Dihydroxycoumarin, dihydroxy-4-methylcoumarin, Coumarin,7-dihydroxy-4-methyl-, ACN-056957, CID5354284, 2H-1-Benzopyran-2-one,7-dihydroxy-4-methyl-, 5,7-Dihydroxy-4-methylcoumarin, 98% - 1G 1g,

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	1.1

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

Lot Number