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AG00E8UG

65399-05-5 | 5-Aminophthalide

AG00E8UG

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CAS Number	65399-05-5
Catalog Number	AG00E8UG(AGN-PC-0JVFKD)
Chemical Name	5-Aminophthalide
EC Number	265-731-1
IUPAC Name	5-amino-3H-2-benzofuran-1-one
InChI	InChI=1S/C8H7NO2/c9-6-1-2-7-5(3-6)4-11-8(7)10/h1-3H,4,9H2
InChI Key	ISMUWQMUWFPFBZ-UHFFFAOYSA-N
MDL Number	MFCD00778315
Molecular Formula	C8H7NO2
Molecular Weight	149.1467
SMILES	O=C1OCC2=C1C=CC(N)=C2
Synonyms	5-Aminophthalide, 65399-05-5, 5-aminoisobenzofuran-1(3H)-one, 5-Amino-3H-isobenzofuran-1-one, 5-amino-2-benzofuran-1(3H)-one, 1(3H)-Isobenzofuranone, 5-amino-, 5-Amino-1(3H)-isobenzofuranone, 5-amino-3H-2-benzofuran-1-one, MFCD00778315, 5-amino-1,3-dihydro-2-benzofuran-1-one, 5-amino-3-hydroisobenzofuran-1-one, 5-Aminophthliade, 5-amino-phthalide, EINECS 265-731-1, zlchem 798, AC1LEZTP, BAS 06910978, AC1Q52CW, AC1Q6HP7, 5-Amino-3H-isobenzofuranone, Oprea1_541725, Oprea1_794500, MLS000719182, SCHEMBL2017652, CHEMBL1493900, CTK7D8464, DTXSID90215707, ZLD0257, ISMUWQMUWFPFBZ-UHFFFAOYSA-N, HMS1610O01, HMS2722B03, ZINC122281, ACT06131, ALBB-025001, EBD14068, ANW-60540, BBL019954, CA-189, RW2807, SBB007358, STK743464, AKOS000111808, MCULE-9871248367, QC-2576, RP21264, VZ30048, NCGC00245409-01, AJ-11787, AK-90309, AN-38632, AS-41237, SC-74723, SMR000291450, ST012328, SY024775, ZB004208, AB0032803, AB1009117, DB-054809, TR-022263, BB 0217042, CS-0059293, FT-0620025, ST24044334, X6227, MFCD00778315 (95%), 5-Amino-2-benzofuran-1(3H)-one, AldrichCPR, W-7578, Z-8859, 399A055, AE-641/30105045, I05-0050, W-104796, 5 Aminophthalide, C8H7NO2, C8-H7-N-O2, 1(3H)-Isobenzofuranone,5-amino-, AR-1G7075, CID720669, ACN-052682, CS-M-05254, 66096-01-3,

Complexity	181
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	149.048g/mol
Formal Charge	0
Heavy Atom Count	11
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	149.149g/mol
Monoisotopic Mass	149.048g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	52.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.1

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H319
Packing Group
Precautionary statements	P305+P351+P338
Signal Words	warning
UN Code

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CERTIFICATE OF ANALYSIS

Chemical Name:	Batch Number:
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Conclusion: The above product meets the specifications of Angene.

Analyst:Chase

Date:

Reviewed by:Jessie

Date:

Angene International Limited