AG019EU8

Name: 7-Nitrophthalide
Brand: Angene Chemical
SKU: AG019EU8

42760-46-3 | 7-Nitrophthalide

AG019EU8

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CAS Number	42760-46-3
Catalog Number	AG019EU8(AGN-PC-0WALNF)
Chemical Name	7-Nitrophthalide
IUPAC Name	7-nitro-3H-2-benzofuran-1-one
InChI	InChI=1S/C8H5NO4/c10-8-7-5(4-13-8)2-1-3-6(7)9(11)12/h1-3H,4H2
InChI Key	BFIGXRQYMBKAIR-UHFFFAOYSA-N
MDL Number	MFCD02091631
Molecular Formula	C8H5NO4
Molecular Weight	179.1296
SMILES	[O-][N+](=O)c1cccc2COC(=O)c12
Synonyms	42760-46-3, 7-NITROISOBENZOFURAN-1(3H)-ONE, 7-Nitro-1(3H)-isobenzofuranone, 7-nitro-3H-2-benzofuran-1-one, 7-nitro-2-benzofuran-1(3H)-one, 7-nitro-3H-isobenzofuran-1-one, 7-Nitrophthalid, AC1LI3Z8, MLS000700525, SCHEMBL7439288, CHEMBL1371316, CTK8E2395, DTXSID60357244, HMS2530A21, ZINC382872, 1(3H)-Isobenzofuranone, 7-nitro-, 7-Nitroisobenzo[b]furan-1(3h)-one, FCH845425, MFCD02091631, AKOS006278522, MCULE-6852880544, ACM42760463, AJ-20357, SMR000229455, 7-nitro-1,3-dihydro-2-benzofuran-1-one, DB-070337, TC-066240, CS-0060621, FT-0658108, A826001, AO-185/13958004, I14-5716, CID848528, ZINC00382872,

Complexity	247
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	179.022g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	179.131g/mol
Monoisotopic Mass	179.022g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	72.1A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.2

CERTIFICATE OF ANALYSIS

Analysis Data:

Test:

Result:

Conclusion: The above product meets the specifications of Angene.

Analyst:Chase

Date:

Reviewed by:Jessie

Date:

Angene International Limited