Vitas-M small molecule compound
3-[(3-ethyl-5-methylphenoxy)methyl]-2,8,9-trioxa-5-aza-1-borabicyclo[3.3.3]undecane
Catalog ID
STK371464
SMILES CCc1cc(OCC2OB3OCCN(C2)CCO3)cc(c1)C
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C16H24BNO4 MW 305.18 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H24BNO4/c1-3-14-8-13(2)9-15(10-14)19-12-16-11-18-4-6-20-17(22-16)21-7-5-18/h8-10,16H,3-7,11-12H2,1-2H3InChIKey
OHVXHXMPJNMAAY-UHFFFAOYSA-NSynonyms
3((3ethyl5methylphenoxy)methyl)289trioxa5aza1borabicyclo(333)undecane
3((3ethyl5methylphenoxy)methyl)4611trioxa1aza5borabicyclo(333)undecane
5ETHYL3METHYL1((289TRIOXA5AZA1BORABICYCLO(333)UNDEC3YL)METHOXY)BENZENE
B12OCCN(CCO1)CC(O2)COC3=CC(=CC(=C3)CC)C
InChI=1SC16H24BNO4c1314813(2)915(1014)1912161118462017(2216)217518h81016H371112H212H3
MFCD00406025
ZINC000195812079
ZINC000195812080
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