AG00ECSX

Name: 4-Nitrophthalide
Brand: Angene Chemical
SKU: AG00ECSX

65399-18-0 | 4-Nitrophthalide

AG00ECSX

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CAS Number	65399-18-0
Catalog Number	AG00ECSX(AGN-PC-0K22OB)
Chemical Name	4-Nitrophthalide
IUPAC Name	4-nitro-3H-2-benzofuran-1-one
InChI	InChI=1S/C8H5NO4/c10-8-5-2-1-3-7(9(11)12)6(5)4-13-8/h1-3H,4H2
InChI Key	NTPUVQUUAYGRHK-UHFFFAOYSA-N
MDL Number	MFCD03069001
Molecular Formula	C8H5NO4
Molecular Weight	179.1296
SMILES	[O-][N+](=O)C1=C2COC(=O)C2=CC=C1
Synonyms	4-NITROPHTHALIDE, 65399-18-0, 4-Nitroisobenzofuran-1(3H)-one, 4-nitro-3H-isobenzofuran-1-one, 4-nitro-3H-2-benzofuran-1-one, NTPUVQUUAYGRHK-UHFFFAOYSA-N, 4-nitro-2-benzofuran-1(3H)-one, 1(3H)-Isobenzofuranone, 4-nitro-, 4-nitro-1,3-dihydro-2-benzofuran-1-one, AC1LNZQG, PubChem22573, SCHEMBL332607, CTK5C2647, DTXSID40361021, ZINC984366, 1(3H)-Isobenzofuranone,4-nitro-, 0018AC, ANW-67960, CN-507, MFCD03069001, AKOS000278077, FCH1119711, LS11798, 1,3-dihydro-4-nitrobenzo[c]furan-1-one, AJ-24637, AK-80918, AN-38633, AS-40445, SY023223, AX8237818, DB-023226, TC-066241, AM20080775, FT-0654356, MFCD03069001 (95%), Z-9100, 399N180, A835100, I14-5723, C8H5NO4, ZINC00984366, CID1211692,

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

GHS Hazard and Precautionary Statements

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