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D154

S(+)-DOI hydrochloride

solid

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About This Item

Empirical Formula (Hill Notation):
C11H16INO2 · HCl
CAS Number:
99665-05-1
Molecular Weight:
357.62
UNSPSC Code:
12352200
PubChem Substance ID:
329798702
MDL number:
MFCD00153797

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form

solid

optical activity

[α]22/D +11.85°, c = 1.9 in H2O(lit.)

drug control

Home Office Schedule 1; regulated under CDSA - not available from Sigma-Aldrich Canada

color

white

solubility

H2O: soluble, ethanol: soluble

SMILES string

Cl.COc1cc(C[C@H](C)N)c(OC)cc1I

InChI

1S/C11H16INO2.ClH/c1-7(13)4-8-5-11(15-3)9(12)6-10(8)14-2;/h5-7H,4,13H2,1-3H3;1H/t7-;/m0./s1

InChI key

QVFDMWGKHUFODK-FJXQXJEOSA-N

Biochem/physiol Actions

Less potent enantiomer of (±)-DOI.

Storage Class

11 - Combustible Solids

wgk

WGK 3

flash_point_f

Not applicable

flash_point_c

Not applicable

ppe

Eyeshields, Gloves, type N95 (US)

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