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Key Documents

493406

Sigma-Aldrich

[3aS-(3aα,4α,5β,7aα)]-5-Azido-7-bromo-3a,4,5,7a-tetrahydro-2,2-dimethyl-1,3-benzodioxol-4-ol

99%

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About This Item

Empirical Formula (Hill Notation):
C9H12BrN3O3
CAS Number:
Molecular Weight:
290.11
MDL number:
UNSPSC Code:
12352005
PubChem Substance ID:
NACRES:
NA.22

assay

99%

optical activity

[α]25/D +24°, c = 1 in chloroform

reaction suitability

reaction type: click chemistry

mp

116-118 °C (lit.)

functional group

azide
bromo
ether
hydroxyl
ketal

storage temp.

−20°C

SMILES string

[H][C@@]12OC(C)(C)O[C@]1([H])C(Br)=C[C@H](N=[N+]=[N-])[C@H]2O

InChI

1S/C9H12BrN3O3/c1-9(2)15-7-4(10)3-5(12-13-11)6(14)8(7)16-9/h3,5-8,14H,1-2H3/t5-,6+,7+,8-/m0/s1

InChI key

PRQOGQGZCPGPSH-OSMVPFSASA-N

pictograms

Exclamation mark

signalword

Warning

Hazard Classifications

Eye Irrit. 2 - Skin Irrit. 2 - STOT SE 3

target_organs

Respiratory system

Storage Class

11 - Combustible Solids

wgk_germany

WGK 3

flash_point_f

Not applicable

flash_point_c

Not applicable


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