Vitas-M small molecule compound

propan-2-yl 4-chloro-3-nitrobenzoate

Catalog ID
STK018877
SMILES CC(OC(=O)c1ccc(c(c1)[N+](=O)[O-])Cl)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 C10H10ClNO4 MW 243.65 g/mol Purity >90% as per NMR
InChI
InChI=1S/C10H10ClNO4/c1-6(2)16-10(13)7-3-4-8(11)9(5-7)12(14)15/h3-6H,1-2H3
InChIKey
SYAIBOZYDSNSJG-UHFFFAOYSA-N
Synonyms
22928-62-7
22928627
CC(C)OC(=O)C1=CC(=C(C=C1)Cl)(N+)(=O)(O)
CC(OC(=O)c1ccc(c(c1)(N+)(=O)(O))Cl)C
InChI=1SC10H10ClNO4c16(2)1610(13)7348(11)9(57)12(14)15h36H12H3
IPROPYL4CHLORO3NITROBENZOATE
ISOPROPYL4CHLORO3NITROBENZOATE
METHYLETHYL4CHLORO3NITROBENZOATE
MFCD03130908
PROPAN2YL4CHLORO3NITROBENZOATE
STK018877
ZINC000000064916
ZINC00064916
ZINC64916

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Available files

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