AG00EF91

Name: Cinnabarinic Acid
Brand: Angene Chemical
SKU: AG00EF91

606-59-7 | Cinnabarinic Acid

AG00EF91

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CAS Number	606-59-7
Catalog Number	AG00EF91(AGN-PC-0JLJTK)
Chemical Name	Cinnabarinic Acid
IUPAC Name	2-amino-3-oxophenoxazine-1,9-dicarboxylic acid
InChI	InChI=1S/C14H8N2O6/c15-10-6(17)4-8-12(9(10)14(20)21)16-11-5(13(18)19)2-1-3-7(11)22-8/h1-4H,15H2,(H,18,19)(H,20,21)
InChI Key	FSBKJYLVDRVPTK-UHFFFAOYSA-N
MDL Number	MFCD18379297
Molecular Formula	C14H8N2O6
Molecular Weight	300.2231
SMILES	O=C1C(N)=C(C(O)=O)C2=NC3=C(C=CC=C3C(O)=O)OC2=C1
Synonyms	cinnabarinic acid, Cinnabarinic acid, 606-59-7, Cinnavalininate, 2-amino-3-oxo-3h-phenoxazine-1,9-dicarboxylic acid, Cinnabaric acid, CHEBI:3715, CHEMBL2322655, 2-Amino-3H-phenoxazin-one-1,9-dicarboxylic acid, 2-Amino-3-oxo-3H-phenoxazin-1,9-dicarboxylic acid, 3H-Phenoxazine-1,9-dicarboxylicacid, 2-amino-3-oxo-, Cinnabarinic acid/, Cinnavalininic acid, AC1L3G7E, AC1Q5T5Q, SCHEMBL11888793, CTK2F4342, DTXSID30209408, BCPP000278, ZINC4096852, ABP000214, BDBM50428068, BN0877, MFCD18379297, Cinnabarinic Acid, >=98% (HPLC), AKOS024457983, BCP9000532, B7592, FT-0665050, C05640, 2-amino-3-oxophenoxazine-1,9-dicarboxylic acid, 3H-Phenoxazin-1,9-dicarboxylic acid, 2-amino-3-oxo-, C14H8N2O6, AR-1D8271, C14-H8-N2-O6, CID114918, C000483, 3H-Phenoxazine-1,9-dicarboxylic acid, 2-amino-3-oxo-, 62423-71-6,

Complexity	675
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	300.038g/mol
Formal Charge	0
Heavy Atom Count	22
Hydrogen Bond Acceptor Count	8
Hydrogen Bond Donor Count	3
Isotope Atom Count	0
Molecular Weight	300.226g/mol
Monoisotopic Mass	300.038g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	139A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.8

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