AG003BDF

71749-03-6 | (3aR,7aR)-Hexahydro-1,3-isobenzofurandione

AG003BDF

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CAS Number	71749-03-6
Catalog Number	AG003BDF(AGN-PC-0OH0U0)
Chemical Name	(3aR,7aR)-Hexahydro-1,3-isobenzofurandione
EC Number	238-009-9
IUPAC Name	(3aR,7aR)-3a,4,5,6,7,7a-hexahydro-2-benzofuran-1,3-dione
InChI	InChI=1S/C8H10O3/c9-7-5-3-1-2-4-6(5)8(10)11-7/h5-6H,1-4H2/t5-,6-/m1/s1
InChI Key	MUTGBJKUEZFXGO-PHDIDXHHSA-N
MDL Number	MFCD00674194
Molecular Formula	C8H10O3
Molecular Weight	154.1632
SMILES	[C@@H]12[C@H](CCCC1)C(=O)OC2=O
Synonyms	71749-03-6, trans-Hexahydroisobenzofuran-1,3-dione, 14166-21-3, (+)-trans-1,2-Cyclohexanedicarboxylic Anhydride, trans-1,2-Cyclohexanedicarboxylic anhydride, (+/-)-trans-1,2-Cyclohexanedicarboxylic Anhydride, (3aR,7aR)-hexahydroisobenzofuran-1,3-dione, MUTGBJKUEZFXGO-PHDIDXHHSA-N, 1,3-Isobenzofurandione, hexahydro-, (3aR,7aR)-, 1,3-Isobenzofurandione, hexahydro-, (3aR,7aR)-rel-, 1,3-Isobenzofurandione, hexahydro-, trans-, trans-Cyclohexane-1,2-dicarboxylic anhydride, trans-Hexahydrophthalic anhydride, PubChem8093, SCHEMBL598374, CTK8B9920, DTXSID60449118, ANW-63573, MFCD00064345, MFCD00674194, Cyclohexanedicarboxylicanhydride; 98%, AKOS015833100, AKOS015900342, ZINC100029554, EBD2204222, FCH1120193, FCH3622188, AK-79087, Hexahydro-2-benzofuran-1,3-dione, trans, trans-Hexahydroisobenzo[b]furan-1,3-dione, AX8043164, DB-074467, TC-152318, (3aR,7aR)-hexahydro-1,3-Isobenzofurandione, FT-0637021, FT-0657907, ST24050224, (3aR,7aR)-hexahydro-2-benzofuran-1,3-dione, 1beta,2alpha-Cyclohexanedicarboxylic anhydride, racemic trans-hexahydroisobenzofuran-1,3-dione, (+)-(R,R)-1,2-Cyclohexanedicarboxylic anhydride, A837311, trans-1,2-cyclohexanedicarboxylic acid anhydride;, I14-3830, I14-3935, (1R,2R)-(-)-1,2-cyclohexane dicarboxylic acid anhydride, (3aR,7aR)-3a,4,5,6,7,7a-hexahydro-2-benzofuran-1,3-dione, (3aR,7aR)-3a,4,5,6,7,7a-hexahydroisobenzofuran-1,3-dione, Lekutherm Hardener H, EINECS 238-009-9, C8-H10-O3, CB10517, CID10942665, (-)-trans-1,2-Cyclohexanedicarboxylic Anhydride, TRANS-1,2-CYCLOHEXANEDICARBOXYLIC ANHYDRIDE, 31982-85-1, 85-42-7,

Complexity	187
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	2
Defined Bond Stereocenter Count	0
Exact Mass	154.063g/mol
Formal Charge	0
Heavy Atom Count	11
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	154.165g/mol
Monoisotopic Mass	154.063g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	43.4A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.2

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	8
Hazard statements	H318-H317-H334
Packing Group	Ⅲ
Precautionary statements	P261-P272-P280-P284-P302+P352-P342+P311-P362+P364-P304+P340-P333+P313-P305+P351+P338+P310-P501
UN Code	UN 1759

Certificate of Analysis

Lot Number