AG0037Y3

37418-88-5 | 4-Hydroxy-2-benzofuran-1,3-dione

AG0037Y3

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CAS Number	37418-88-5
Catalog Number	AG0037Y3(AGN-PC-0WAJ35)
Chemical Name	4-Hydroxy-2-benzofuran-1,3-dione
IUPAC Name	4-hydroxy-2-benzofuran-1,3-dione
InChI	InChI=1S/C8H4O4/c9-5-3-1-2-4-6(5)8(11)12-7(4)10/h1-3,9H
InChI Key	CCTOEAMRIIXGDJ-UHFFFAOYSA-N
MDL Number	MFCD00011557
Molecular Formula	C8H4O4
Molecular Weight	164.1150
NSC Number	80858
SMILES	OC1=CC=CC=2C(OC(C21)=O)=O
Synonyms	3-HP anhydride, 3-hydroxyphthalic anhydride, 37418-88-5, 3-Hydroxyphthalic anhydride, 4-hydroxyisobenzofuran-1,3-dione, 4-hydroxy-2-benzofuran-1,3-dione, 3-Hydroxyphthalic acid anhydride, 1,3-Isobenzofurandione, 4-hydroxy-, 4-Hydroxy-isobenzofuran-1,3-dione, NSC 80858, 4-hydroxy-1,3-dihydro-2-benzofuran-1,3-dione, BRN 0135783, Phthalic anhydride, 3-hydroxy-, 1,3-Isobenzofurandione,4-hydroxy-, 3-Hydroxyphthalic anhydride, 97%, 3-Hydroxyphthalicanhydride, 3-Hydroxyphthalic anhydride treated .beta.-lactoglobulin from bovine whey, 1,?3-?Isobenzofurandione, 4-?hydroxy-, hydroxyphthalic anhydride, AC1L3WRO, 5-18-03-00184 (Beilstein Handbook Reference), Phthalic anhydride, 3-hydroxy, SCHEMBL382951, AC1Q794H, CHEMBL2057864, CTK4H8126, DTXSID10190860, 3-Hydroxy-phthalic acid anhydride, CCTOEAMRIIXGDJ-UHFFFAOYSA-N, 3-Hydroxyphthalic anhydride, 98%, BCP15658, NSC80858, ZINC8100889, 4775AB, ANW-58549, BBL036792, MFCD00011557, NSC-80858, SBB059273, STK930474, AKOS005660534, CS-W005592, LS41143, MCULE-7655675146, VZ26962, 3-Hydroxyphthalic anhydride treated BSA, 3-Hydroxyphthalic anhydride treated whey, 3-Hydroxyphthalic anhydride treated casein, AC-29923, AK-80295, AS-10283, BP-13154, SC-86620, SY039506, DB-008314, LS-109377, TX-018184, 3-Hydroxyphthalic anhydride treated egg white, A6397, FT-0639372, ST51037617, KS-00000559, MFCD00011557 (97%), L-2473, 3-Hydroxy-1,2-benzenedicarboxylic acid; Anhydride, 3-Hydroxyphthalic anhydride treated purified ovomucoid, I14-49955, 3-Hydroxyphthalic anhydride treated bovine serum albumin, 3-Hydroxyphthalic anhydride treated egg albumin grade IV, F2147-1038, 3-Hydroxyphthalic anhydride treated non-fat dry milk powder, 3-Hydroxyphthalic anhydride treated partially purified ovomucoid, C8H4O4, C8-H4-O4, CID96580, ACN-038465, 3-Hydroxyphthalic anhydride, 98% - 250MG 250mg, DTHKSEIAHRFKDLGEEQFKGLVLIAFSQYLQQCPFDEHVKLVNELTEFAKTCVADESHAGCEKSLHTLFGDELCKVASLRETYGDMADCCEKQEPERNECFLSHKDDSPDLPKLKPDPNTLCDEFKADEKKFWGKYLYEIARRHPYFYAPELLYYANKYNGVFQDCCQAEDKGACLLPKIETMREKVLASSARQRLRCASIQKFGERALKAWSVARLSQKFPKAEFVEVTKLVTDLTKVHKECCHGDLLECADDRADLAKYICDNQDTISSKLKECCDKPLLEKSHCIAEVEKDAIPENLPPLTADFAEDKDVCKNYQEAKDAFLGSFLYEYSRRHPEYAVSVLLRLAKEYEATLEECCAKDDPHACYSTVFDKLKHLVDEPQNLIKQNCDQFEKLGEYGFQNALIVRYTRKVPQVSTPTLVEVSRSLGKVGTRCCTKPESERMPCTEDYLSLILNRLCVLHEKTPVSEKVTKCCTESLVNRRPCFSALTPDETYVPKAFDEKLFTFHADICTLPDTEKQIKKQTALVELLKHKPKATEEQLKTVMENFVAFVDKCCAADDKEACFAVEGPKLVVSTQTALA,

Complexity	235
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	164.011g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	164.116g/mol
Monoisotopic Mass	164.011g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	63.6A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.5

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