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About This Item
Empirical Formula (Hill Notation):
C20H26N2O2 · HBr · xH2O
CAS Number:
Molecular Weight:
407.34 (anhydrous basis)
NACRES:
NA.22
PubChem Substance ID:
UNSPSC Code:
12352005
MDL number:
assay
98%
form
powder
optical activity
[α]25/D −100°, c = 1.9 in H2O
SMILES string
O.Br.CC[C@H]1CN2CC[C@H]1C[C@H]2[C@@H](O)c3ccnc4ccc(OC)cc34
InChI
1S/C20H26N2O2.BrH.H2O/c1-3-13-12-22-9-7-14(13)10-19(22)20(23)16-6-8-21-18-5-4-15(24-2)11-17(16)18;;/h4-6,8,11,13-14,19-20,23H,3,7,9-10,12H2,1-2H3;1H;1H2/t13-,14-,19-,20-;;/m0../s1
InChI key
IWSVSZYIGVGHCN-QTEGFKMESA-N
signalword
Warning
hcodes
Hazard Classifications
Eye Irrit. 2 - Skin Irrit. 2 - STOT SE 3
target_organs
Respiratory system
Storage Class
11 - Combustible Solids
wgk
WGK 3
flash_point_f
Not applicable
flash_point_c
Not applicable
ppe
dust mask type N95 (US), Eyeshields, Gloves
Regulatory Information
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Global Trade Item Number
| SKU | GTIN |
|---|---|
| 341320-1G | 04061826262528 |
