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AG00ABOO

Name: NQDI 1
Brand: Angene Chemical
SKU: AG00ABOO

175026-96-7 | NQDI 1

Chemical structure of NQDI 1, CAS 175026-96-7

AG00ABOO

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CAS Number	175026-96-7
Catalog Number	AG00ABOO(AGN-PC-0QAOHO)
Chemical Name	NQDI 1
IUPAC Name	ethyl 8,15-dioxo-14-azatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9(17),10,12-heptaene-16-carboxylate
InChI	InChI=1S/C19H13NO4/c1-2-24-19(23)16-15-10-6-3-4-7-11(10)17(21)12-8-5-9-13(14(12)15)20-18(16)22/h3-9H,2H2,1H3,(H,20,22)
InChI Key	UFJGFNHRMPMALC-UHFFFAOYSA-N
MDL Number	MFCD03265970
Molecular Formula	C19H13NO4
Molecular Weight	319.3108
SMILES	O=C(C1=C2C3=C(NC1=O)C=CC=C3C(C4=C2C=CC=C4)=O)OCC
Synonyms	2,7-dioxo-2,7-dihydro-3H-naphtho(1,2,3-de)quinoline-1-carboxylate, NQDI 1, NQDI-1, NQDI-1, 175026-96-7, NQDI 1, MLS000715851, CHEMBL1345690, SMR000277368, ethyl 2,7-dioxo-3,7-dihydro-2H-naphtho[1,2,3-de]quinoline-1-carboxylate, ethyl 2,7-dioxo-2,7-dihydro-3H-naphtho[1,2,3-de]quinoline-1-carboxylate, 2,7-Dihydro-2,7-dioxo-3H-naphtho[1,2,3-de]quinoline-1-carboxylic acid ethyl ester, BAS 05532741, Oprea1_384256, Oprea1_559557, IFLab1_005737, SCHEMBL17949560, BDBM32315, cid_5522952, EX-A820, HMS1428E17, HMS2646I12, BCP16684, ZINC5644396, MFCD03265970, s8289, STK793109, STL514199, AKOS000594203, CS-5290, MCULE-5948216916, NQDI-1, >=98% (HPLC), IDI1_011140, AK547550, HY-19566, ST4083161, FT-0700243, AB00686019-01, AQ-390/42425636, J-011056, F1414-1232, A3103/0131406, ethyl 2-hydroxy-7-oxo-7H-naphtho[1,2,3-de]quinoline-1-carboxylate, Ethyl 2,7-dioxo-2,7-dihydro-3H-naphtho[1,2,3-de]quinoline-1-carbo xylate, NQDI1, CID5522952, A4474, A12838, C000592751, 2,7-dioxo-2,7-dihydro-3H-naphtho(1,2,3-de)quinoline-1-carboxylate,

Complexity	623
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	319.084g/mol
Formal Charge	0
Heavy Atom Count	24
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	319.316g/mol
Monoisotopic Mass	319.084g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	72.5A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.5

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	\N
Hazard statements	H302
Packing Group	\N
Precautionary statements	P280-P305+P351+P338
UN Code	\N

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Conclusion: The above product meets the specifications of Angene.

Analyst:Chase

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Reviewed by:Jessie

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Angene International Limited