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Merck
CN

267988

Isodrine

Synonym(s):

1,2,3,4,10,10-Hexachloro-1,4,4a,5,8,8a-hexahydro-endo,endo-1,4:5,8-dimethanonaphthalene

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About This Item

Empirical Formula (Hill Notation):
C12H8Cl6
CAS Number:
Molecular Weight:
364.91
UNSPSC Code:
12352100
NACRES:
NA.22
PubChem Substance ID:
EC Number:
207-366-2
Beilstein/REAXYS Number:
2509251
MDL number:
Form:
solid
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InChI key

QBYJBZPUGVGKQQ-DIFDVCDBSA-N

InChI

1S/C12H8Cl6/c13-8-9(14)11(16)7-5-2-1-4(3-5)6(7)10(8,15)12(11,17)18/h1-2,4-7H,3H2/t4-,5+,6-,7+,10-,11+

SMILES string

[H][C@@]12C3CC(C=C3)[C@]1([H])[C@]4(Cl)C(Cl)=C(Cl)[C@@]2(Cl)C4(Cl)Cl

form

solid

mp

239-241 °C (lit.)

functional group

chloro

Quality Level

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General description

Isodrine has rigid molecules with two double bonds facing each other closely that represents the simplest laticyclic conjugated system. The through space interaction in isodrine was studied.

pictograms

Skull and crossbonesEnvironment

signalword

Danger

Hazard Classifications

Acute Tox. 1 Dermal - Acute Tox. 2 Inhalation - Acute Tox. 2 Oral - Aquatic Acute 1 - Aquatic Chronic 1

Storage Class

6.1A - Combustible acute toxic Cat. 1 and 2 / very toxic hazardous materials

wgk

WGK 2

flash_point_f

Not applicable

flash_point_c

Not applicable

ppe

Eyeshields, Faceshields, Gloves, type P3 (EN 143) respirator cartridges

Regulatory Information

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Laticyclic conjugated double bonds within the framework of oligocondensed bicyclo [2.2. 2] octenes.
Grimme W, et al.
J. Chem. Soc. Perkin Trans. II, 9, 1893-1900 (1998)

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