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Cacotheline Monohydrate 98.0+%, TCI America™

Supplier: TCI America C00015G

Catalog No. C00015G

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Quantity

Specifications

Chemical Name or Material	Cacotheline Monohydrate
Molecular Formula	C21H21N3O7
Quantity	5 g
InChI Key	IVEMPCACOMNRGI-UHFFFAOYNA-N
IUPAC Name	2-{9-nitro-7,8-dioxo-15-oxa-1,11-diazahexacyclo[16.3.1.0â´,Â¹Â².0â´,Â²Â¹.0âµ,Â¹â°.0Â¹Â³,Â¹â¹]docosa-5,9,17-trien-14-yl}acetic acid
PubChem CID	101667989
Percent Purity	≥98.0% (T)

CAS	561-20-6
MDL Number	MFCD00077211
UN Number	2811
SMILES	OC(=O)CC1OCC=C2CN3CCC45C3CC2C1C4NC1=C(C(=O)C(=O)C=C51)[N+]([O-])=O
Molecular Weight (g/mol)	427.41
Formula Weight	490.43
Physical Form	Crystalline Powder

Chemical Identifiers

CAS	561-20-6
Molecular Weight (g/mol)	427.41
InChI Key	IVEMPCACOMNRGI-UHFFFAOYNA-N
IUPAC Name	2-{9-nitro-7,8-dioxo-15-oxa-1,11-diazahexacyclo[16.3.1.0â´,Â¹Â².0â´,Â²Â¹.0âµ,Â¹â°.0Â¹Â³,Â¹â¹]docosa-5,9,17-trien-14-yl}acetic acid

Molecular Formula	C21H21N3O7
MDL Number	MFCD00077211
PubChem CID	101667989
SMILES	OC(=O)CC1OCC=C2CN3CCC45C3CC2C1C4NC1=C(C(=O)C(=O)C=C51)[N+]([O-])=O

Product Suggestions Safety and Handling

TSCA : Yes