Vitas-M small molecule compound

3-methylbutyl [4-(dimethylamino)phenyl][hydroxy(4-methylphenyl)methyl]phosphinate

Catalog ID
STL055457
SMILES CC(CCOP(=O)(C(c1ccc(cc1)C)O)c1ccc(cc1)N(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 C21H30NO3P MW 375.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H30NO3P/c1-16(2)14-15-25-26(24,20-12-10-19(11-13-20)22(4)5)21(23)18-8-6-17(3)7-9-18/h6-13,16,21,23H,14-15H2,1-5H3
InChIKey
ZMDMYYXWJFSAGA-UHFFFAOYSA-N
Synonyms

((4(dimethylamino)phenyl)(3methylbutoxy)phosphoryl)(4methylphenyl)methanol
((4DIMETHYLAMINOPHENYL)(3METHYLBUTOXY)PHOSPHORYL)(4METHYLPHENYL)METHANOL
3methylbutyl(4(dimethylamino)phenyl)(hydroxy(4methylphenyl)methyl)phosphinate
CC1=CC=C(C=C1)C(O)P(=O)(C2=CC=C(C=C2)N(C)C)OCCC(C)C
InChI=1SC21H30NO3Pc116(2)14152526(2420121019(111320)22(4)5)21(23)188617(3)7918h613162123H1415H215H3
isopentyl(4(dimethylamino)phenyl)(hydroxy(ptolyl)methyl)phosphinate
MFCD04016777
ZINC000005029735
ZINC000005029742

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.