AG003DB1

552-30-7 | 1,3-Dihydro-1,3-dioxo-5-isobenzofurancarboxylic acid

AG003DB1

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CAS Number	552-30-7
Catalog Number	AG003DB1(AGN-PC-0JK9V5)
Chemical Name	1,3-Dihydro-1,3-dioxo-5-isobenzofurancarboxylic acid
EC Number	209-008-0
IUPAC Name	1,3-dioxo-2-benzofuran-5-carboxylic acid
InChI	InChI=1S/C9H4O5/c10-7(11)4-1-2-5-6(3-4)9(13)14-8(5)12/h1-3H,(H,10,11)
InChI Key	SRPWOOOHEPICQU-UHFFFAOYSA-N
MDL Number	MFCD00005925
Molecular Formula	C9H4O5
Molecular Weight	192.1251
NSC Number	60252
RTECS Number	DC2050000
SMILES	O=C1c2c(C(=O)O1)ccc(c2)C(=O)O
UNII	80T61EUU7H
Synonyms	tri-mellitic anhydride, trimellitic anhydride, TRIMELLITIC ANHYDRIDE, 552-30-7, 1,2,4-Benzenetricarboxylic anhydride, 1,3-Dioxo-1,3-dihydroisobenzofuran-5-carboxylic acid, Anhydrotrimellic acid, 4-Carboxyphthalic anhydride, Trimellitic acid anhydride, TMAN, Anhydrotrimellitic acid, Trimellic acid anhydride, Trimellitic acid 1,2-anhydride, Trimellic acid 1,2-anhydride, 1,3-Dioxo-5-phthalancarboxylic acid, Trimellitic acid cyclic 1,2-anhydride, 5-Isobenzofurancarboxylic acid, 1,3-dihydro-1,3-dioxo-, 1,2,4-Benzenetricarboxylic acid anhydride, Epon 9150, 1,3-Dihydro-1,3-dioxo-5-isobenzofurancarboxylic acid, 1,2,4-Benzenetricarboxylic acid 1,2-anhydride, NCI-C56633, Anhydride-ethomid ht polymer, 1,3-Dioxo-1,3-dihydro-2-benzofuran-5-carboxylic acid, UNII-80T61EUU7H, NSC 60252, 1,2,4-Benzenetricarboxylic acid, cyclic 1,2-anhydride, CCRIS 6282, 5-Phthalanacarboxylic acid, 1,3-dioxo-, CHEBI:53050, HSDB 4299, Benzene-1,2,4-tricarboxylic-1,2-anhydride, 1,2,4-Benzenetricarboxylicanhydride, EINECS 209-008-0, BRN 0009394, 1,3-dioxoisobenzofuran-5-carboxylic acid, 80T61EUU7H, SRPWOOOHEPICQU-UHFFFAOYSA-N, Benzene-1,2,4-tricarboxylic acid 1,2-anhydride, Diphenylmethane-4,4'-diisocyanate-trimellic anhydride-ethomid HT polymer, MFCD00005925, Benzene-1,2,4-tricarboxylic anhydride, 1,3-dioxo-5-isobenzofurancarboxylic acid, Benzene-1,2,4-tricarboxylic acidanhydride, 1,2,4-Benzenetricarboxylic anhydride, 97%, DSSTox_CID_6235, DSSTox_RID_78070, DSSTox_GSID_26235, 1,3-Dioxo-1,3-dihydro-isobenzofuran-5-carboxylic acid, CAS-552-30-7, Trimellitic a, C9H4O5, cyclic 1,2-anhydride, AC1L1WLE, Epitope ID:113235, EC 209-008-0, AC1Q73RK, SCHEMBL22458, Trimellitic acid,2-anhydride, 5-18-08-00562 (Beilstein Handbook Reference), KSC924O7T, Trimellic acid-1,2-anhydride, WLN: T56 BVOVJ GVQ, Trimellitic anhydride-dendrimers, CHEMBL2137687, DTXSID7026235, CTK8C4779, KS-00000VAA, Trimellitic anhydride treated BSA, Trimellitic anhydride treated HSA, Trimellitic anhydride treated IgG, 1,4-Benzenetricarboxylic anhydride, EBD31577, NSC60252, Trimellitic anhydride treated casein, Tox21_202066, Tox21_303117, 5-Phthalanacarboxylic acid,3-dioxo-, AC-811, ANW-73108, BBL010496, LS-215, NSC-60252, SBB040551, STL146149, ZINC22346496, 1,2,4 benzenetricarboxylic anhydride, 1,2,4-benzene tricarboxylic anhydride, AKOS000120069, CS-W015822, MCULE-9203159058, NE10418, RP25154, RTR-019476, Trimellitic anhydride treated hemoglobin, 1,4-Benzenetricarboxylic acid anhydride, NCGC00164022-01, NCGC00164022-02, NCGC00256953-01, NCGC00259615-01, AK106238, AN-15525, BC200741, BP-13468, SC-18491, Trimellitic anhydride-trypsin treated BSA, 1,2,4 benzenetricarboxylic acid anhydride, 1,3-dioxo-2-benzofuran-5-carboxylic acid, 1,2,4-Benzenetricarboxylic 1,2-Anhydride, 1,2,4-benzenetricarboxylic acid anhydride;, 1,4-Benzenetricarboxylic acid 1,2-anhydride, C0959, FT-0689091, ST24036817, ST50213924, Trimellitic anhydride treated human transferrin, Trimellitic anhydride, purum, >=97.0% (T), 1,2,4-Benzenetricarboxylic acid anhydride-1,2, Trimellitic anhydride treated human serum albumin, 4-Carboxyphthalic anhydride, Trimellitic anhydride, A830542, Trimellitic anhydride treated bovine serum albumin, W-105576, 1,4-Benzenetricarboxylic acid, cyclic 1,2-anhydride, 5-Isobenzofurancarboxylic acid,3-dihydro-1,3-dioxo-, I14-13428, Trimellitic anhydride treated non-fat dry milk powder, 1,2,4-Benzenetricarboxylic anhydride treated hemoglobin, 1,3-bis(oxidanylidene)-2-benzofuran-5-carboxylic acid, F0001-1448, 1,3-Dioxo-1,3-dihydro-isobenzofuran-5-carboxylic acid #, Trimellitic anhydride-trypsin treated bovine serum albumin, 1,2,4-Benzenetricarboxylic acid, cyclic 1,2-anhydride (8CI), 1,2,4-Benzenetricarboxylic anhydride;Trimellitic anhydride;TMA, Trimellitic anhydride treated .beta.-lactoglobulin from bovine whey, 1,2,4-Benzenetricarboxylic anhydride treated .beta.-lactoglobulin from bovine whey, InChI=1/C9H4O5/c10-7(11)4-1-2-5-6(3-4)9(13)14-8(5)12/h1-3H,(H,10,11, tri-mellitic anhydride, 1,2,4-Benzenetricarboxylic acid, C9-H4-O5, CID11089, c0046, NA8027, TMA, C015559, 1,2,4-Benzenetricarboxylic acid, cyclic-1,2-anhydride, 1,2,4-Benzenetricarboxylic anhydride, 98% - 1KG 1kg, 1,2,4-Benzentrikarboksylsyre-1,2-anhydrid (Trimellitsyreanhydrid), DAHKSEVAHRFKDLGEENFKALVLIAFAQYLQQCPFEDHVKLVNEVTEFAKTCVADESAENCDKSLHTLFGDKLCTVATLRETYGEMADCCAKQEPERNECFLQHKDDNPNLPRLVRPEVDVMCTAFHDNEETFLKKYLYEIARRHPYFYAPELLFFAKRYKAAFTECCQAADKAACLLPKLDELRDEGKASSAKQRLKCASLQKFGERAFKAWAVARLSQRFPKAEFAEVSKLVTDLTKVHTECCHGDLLECADDRADLAKYICENQDSISSKLKECCEKPLLEKSHCIAEVENDEMPADLPSLAADFVESKDVCKNYAEAKDVFLGMFLYEYARRHPDYSVVLLLRLAKTYETTLEKCCAAADPHECYAKVFDEFKPLVEEPQNLIKQNCELFEQLGEYKFQNALLVRYTKKVPQVSTPTLVEVSRNLGKVGSKCCKHPEAKRMPCAEDYLSVVLNQLCVLHEKTPVSDRVTKCCTESLVNRRPCFSALEVDETYVPKEFNAETFTFHADICTLSEKERQIKKQTALVELVKHKPKATKEQLKAVMDDFAAFVEKCCKADDKETCFAEEGKKLVAASQAALGL, DTHKSEIAHRFKDLGEEQFKGLVLIAFSQYLQQCPFDEHVKLVNELTEFAKTCVADESHAGCEKSLHTLFGDELCKVASLRETYGDMADCCEKQEPERNECFLSHKDDSPDLPKLKPDPNTLCDEFKADEKKFWGKYLYEIARRHPYFYAPELLYYANKYNGVFQDCCQAEDKGACLLPKIETMREKVLASSARQRLRCASIQKFGERALKAWSVARLSQKFPKAEFVEVTKLVTDLTKVHKECCHGDLLECADDRADLAKYICDNQDTISSKLKECCDKPLLEKSHCIAEVEKDAIPENLPPLTADFAEDKDVCKNYQEAKDAFLGSFLYEYSRRHPEYAVSVLLRLAKEYEATLEECCAKDDPHACYSTVFDKLKHLVDEPQNLIKQNCDQFEKLGEYGFQNALIVRYTRKVPQVSTPTLVEVSRSLGKVGTRCCTKPESERMPCTEDYLSLILNRLCVLHEKTPVSEKVTKCCTESLVNRRPCFSALTPDETYVPKAFDEKLFTFHADICTLPDTEKQIKKQTALVELLKHKPKATEEQLKTVMENFVAFVDKCCAADDKEACFAVEGPKLVVSTQTALA, VPDKTVRWCAVSEHEATKCQSFRDHMKSVIPSDGPSVACVKKASYLDCIRAIAANEADAVTLDAGLVYDAYLAPNNLKPVVAEFYGSKEDPQTFYYAVAVVKKDSGFQMNQLRGKKSCHTGLGRSAGWNIPIGLLYCDLPEPRKPLEKAVANFFSGSCAPCADGTDFPQLCQLCPGCGCSTLNQYFGYSGAFKCLKDGAGDVAFVKHSTIFENLANKADRDQYELLCLDNTRKPVDEYKDCHLAQVPSHTVVARSMGGKEDLIWELLNQAQEHFGKDKSKEFQLFSSPHGKDLLFKDSAHGFLKVPPRMDAKMYLGYEYVTAIRNLREGTCPEAPTDECKPVKWCALSHHERLKCDEWSVNSVGKIECVSAETTEDCIAKIMNGEADAMSLDGGFVYIAGKCGLVPVLAENYNKSDNCEDTPEAGYFAVAVVKKSASDLTWDNLKGKKSCHTAVGRTAGWNIPMGLLYNKINHCRFDEFFSEGCAPGSKKDSSLCKLCMGSGLNLCEPNNKEGYYGYTGAFRCLVEKGDVAFVKHQTVPQNTGGKNPDPWAKNLNEKDYELLCLDGTRKPVEEYANCHLARAPNHAVVTRKDKEACVHKILRQQQHLFGSNVTDCSGNFCLFRSETKDLLFRDDTVCLAKLHDRNTYEKYLGEEYVKAVGNLRKCSTSSLLEACTFRRP,

Complexity	308
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	192.006g/mol
Formal Charge	0
Heavy Atom Count	14
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	192.126g/mol
Monoisotopic Mass	192.006g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	80.7A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.8

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	8(6.1)
Hazard statements	H317-H318-H334-H335
Packing Group	Ⅲ
Precautionary statements	P261-P271-P272-P280-P285-P302+P352-P304+P340+P312-P305+P351+P338+P310-P333+P313-P342+P311-P363-P403+P233-P405-P501
UN Code	UN 2922

Certificate of Analysis

Lot Number