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About This Item
Empirical Formula (Hill Notation):
C10H11N3O
CAS Number:
Molecular Weight:
189.21
NACRES:
NA.22
PubChem Substance ID:
UNSPSC Code:
12352100
EC Number:
226-672-7
MDL number:
Assay:
97%
Quality Level
assay
97%
mp
142-145 °C (lit.)
SMILES string
NNC(=O)Cc1c[nH]c2ccccc12
InChI
1S/C10H11N3O/c11-13-10(14)5-7-6-12-9-4-2-1-3-8(7)9/h1-4,6,12H,5,11H2,(H,13,14)
InChI key
GYHLCXMCGCVVCG-UHFFFAOYSA-N
Related Categories
Application
Reactant for preparation of:
- Antifungal agents
- Anticonvulsant agents
- Alpha-4 (α4) integrin antagonists
- A fluorescent analogue of UDP-N-acetylglucosamine
- Antioxidant agents with myocardial protection properties
- Antagonist agents of neuropeptide Y receptors
- Antibacterial agents
- Potential monoamine oxidase inhibitors
signalword
Warning
hcodes
Hazard Classifications
Acute Tox. 4 Oral - 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
Regulatory Information
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Global Trade Item Number
| SKU | GTIN |
|---|---|
| I3777-10G | 04061832844527 |
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