TBE-31

TBE-31

Catalog	BR00028610
CAS	936475-62-6
Synonyms	TBE-31; TBE 31; TBE31;
IUPAC Name	(4bS,8aR,10aS)-10a-ethynyl-4b,8,8-trimethyl-3,7-dioxo-3,4b,7,8,8a,9,10,10a-octahydrophenanthrene-2,6-dicarbonitrile
Molecular Weight	330.38 g/mol
Molecular Formula	C21H18N2O2
Canonical SMILES	N#CC(C(C=C1[C@@]2(C)C=C3C#N)=O)=C[C@]1(C#C)CC[C@H]2C(C)(C)C3=O
InChI	InChI=1S/C21H18N2O2/c1-5-21-7-6-16-19(2,3)18(25)14(12-23)9-20(16,4)17(21)8-15(24)13(10-21)11-22/h1,8-10,16H,6-7H2,2-4H3/t16-,20-,21-/m0/s1
InChI Key	ISZIRXMFUSQQOS-NDXORKPFSA-N
Purity	≥98%
Appearance	Solid powder
Shelf Life	>2 years if stored properly
Storage	Dry, dark and at 0 - 4 C for short term (days to weeks) or -20 C for long term (months to years).
Drug Formulation	This drug may be formulated in DMSO
Elemental Analysis	C, 76.34; H, 5.49; N, 8.48; O, 9.69
Exact Mass	330.1368
HS Tariff Code	2934.99.9001
Shipping	Shipped under ambient temperature as non-hazardous chemical. This product is stable enough for a few weeks during ordinary shipping and time spent in Customs.
Stock Solution Storage	0 - 4 C for short term (days to weeks), or -20 C for long term (months).

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