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About This Item
Empirical Formula (Hill Notation):
C6H13N
CAS Number:
Molecular Weight:
99.17
UNSPSC Code:
12352100
NACRES:
NA.22
PubChem Substance ID:
EC Number:
203-642-1
Beilstein/REAXYS Number:
79804
MDL number:
Assay:
98%
Form:
liquid
assay
98%
form
liquid
refractive index
n20/D 1.445 (lit.)
bp
118-119 °C/753 mmHg (lit.)
density
0.844 g/mL at 25 °C (lit.)
SMILES string
CC1CCCCN1
InChI
1S/C6H13N/c1-6-4-2-3-5-7-6/h6-7H,2-5H2,1H3
InChI key
NNWUEBIEOFQMSS-UHFFFAOYSA-N
Application
Reactant for C-2 arylation of piperidines through directed transition metal-catalyzed sp3 C-H activation
Reactant for synthesis of:
Reactant for synthesis of:
- Azepan-4-ones via two step [5+2] annulation
- 2-Aminobenzoxazoles
- Unsymmetrically substituted ureas
- Corticotropin-releasing factor receptor type 1 antagonists
- Gefitinib analogues with anti-tumor activity
signalword
Danger
Hazard Classifications
Acute Tox. 3 Dermal - Acute Tox. 3 Inhalation - Acute Tox. 4 Oral - Eye Dam. 1 - Flam. Liq. 2 - Skin Corr. 1B
Storage Class
3 - Flammable liquids
wgk
WGK 3
flash_point_f
50.0 °F - closed cup
flash_point_c
10 °C - closed cup
ppe
Eyeshields, Faceshields, Gloves, type ABEK (EN14387) respirator filter
Regulatory Information
危险化学品
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Xiaoqing Wu et al.
Bioorganic & medicinal chemistry, 18(11), 3812-3822 (2010-05-15)
There is an urgent need to design and develop new and more potent EGFR inhibitors with improved anti-tumor activity. Here we describe the design and synthesis of two series of 4-benzothienyl amino quinazolines as new analogues of the EGFR inhibitor
Christopher L Cioffi et al.
The Journal of organic chemistry, 75(22), 7942-7945 (2010-10-27)
The synthesis of 2-aminobenzoxazoles can be readily achieved by two versatile, one-pot procedures utilizing commercially available tetramethyl orthocarbonate or 1,1-dichlorodiphenoxymethane, an amine, and an optionally substituted 2-aminophenol. The reactions were conducted under mild conditions and provided 2-aminobenzoxazoles in modest to
C-2 arylation of piperidines through directed transition-metal-catalyzed sp3 C-H activation.
Hana Prokopcová et al.
Chemistry (Weinheim an der Bergstrasse, Germany), 16(44), 13063-13067 (2010-10-29)
Global Trade Item Number
| SKU | GTIN |
|---|---|
| M72803-100ML | 04061837778612 |


