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About This Item
Empirical Formula (Hill Notation):
C6H6ClNO
CAS Number:
Molecular Weight:
143.57
MDL number:
UNSPSC Code:
12352100
PubChem Substance ID:
Assay:
97%
assay
97%
refractive index
n20/D 1.5260 (lit.)
bp
181-182 °C (lit.)
density
1.193 g/mL at 25 °C (lit.)
SMILES string
COc1ccc(Cl)cn1
InChI
1S/C6H6ClNO/c1-9-6-3-2-5(7)4-8-6/h2-4H,1H3
InChI key
NPYYXUYLIHZYOU-UHFFFAOYSA-N
Application
Reactant for:
- Preparation of biaryls via palladium-catalyzed Hiyama cross-coupling with aryltrifluorosilanes
- Suzuki-Miyaura cross-coupling reactions
Storage Class
3 - Flammable liquids
wgk
WGK 3
flash_point_f
127.9 °F - closed cup
flash_point_c
53.3 °C - closed cup
ppe
Eyeshields, Faceshields, Gloves, type ABEK (EN14387) respirator filter
signalword
Warning
hcodes
Hazard Classifications
Acute Tox. 4 Oral - Flam. Liq. 3 - Skin Irrit. 2
Regulatory Information
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Global Trade Item Number
| SKU | GTIN |
|---|---|
| 642967-10G | 04061837605154 |
| 642967-1G | 04061837605161 |

