Vitas-M small molecule compound

5-methyl-2-(propan-2-yl)cyclohexyl [1,3-benzodioxol-5-yl(hydroxy)methyl][4-(dimethylamino)phenyl]phosphinate

Catalog ID
STK532199
SMILES CC1CCC(C(C1)OP(=O)(C(c1ccc2c(c1)OCO2)O)c1ccc(cc1)N(C)C)C(C)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 C26H36NO5P MW 473.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H36NO5P/c1-17(2)22-12-6-18(3)14-24(22)32-33(29,21-10-8-20(9-11-21)27(4)5)26(28)19-7-13-23-25(15-19)31-16-30-23/h7-11,13,15,17-18,22,24,26,28H,6,12,14,16H2,1-5H3
InChIKey
SSDWZRQHJNXSIH-UHFFFAOYSA-N
Synonyms

13benzodioxol5yl((4(dimethylamino)phenyl)(5methyl2propan2ylcyclohexyl)oxyphosphoryl)methanol
13BENZODIOXOL5YL((4DIMETHYLAMINOPHENYL)(5METHYL2PROPAN2YLCYCLOHEXYL)OXYPHOSPHORYL)METHANOL
2isopropyl5methylcyclohexyl(benzo(d)(13)dioxol5yl(hydroxy)methyl)(4(dimethylamino)phenyl)phosphinate
5METHYL2(1METHYLETHYL)CYCLOHEXYL(13BENZODIOXOL5YL(HYDROXY)METHYL)(4(DIMETHYLAMINO)PHENYL)PHOSPHINATE
5methyl2(propan2yl)cyclohexyl(13benzodioxol5yl(hydroxy)methyl)(4(dimethylamino)phenyl)phosphinate
CC1CCC(C(C1)OP(=O)(C2=CC=C(C=C2)N(C)C)C(C3=CC4=C(C=C3)OCO4)O)C(C)C
InChI=1SC26H36NO5Pc117(2)2212618(3)1424(22)3233(292110820(91121)27(4)5)26(28)197132325(1519)31163023h7111315171822242628H6121416H215H3
MFCD01954935
ZINC000009335028
ZINC000239412460

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Available files

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