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About This Item
Empirical Formula (Hill Notation):
C9H9N
CAS Number:
Molecular Weight:
131.17
Beilstein:
109781
EC Number:
MDL number:
UNSPSC Code:
12352100
PubChem Substance ID:
NACRES:
NA.22
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Assay
98%
bp
273 °C (lit.)
mp
57-59 °C (lit.)
SMILES string
Cc1cc2ccccc2[nH]1
InChI
1S/C9H9N/c1-7-6-8-4-2-3-5-9(8)10-7/h2-6,10H,1H3
InChI key
BHNHHSOHWZKFOX-UHFFFAOYSA-N
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Application
Reactant for:
- Regioselective synthesis of oxopyrrolidine analogs via iodine-catalyzed Markovnikov addition reaction
- Friedel-Crafts alkylation reactions
- Preparation of tryptophan dioxygenase inhibitors pyridyl-ethenyl-indoles as potential anticancer immunomodulators
- Preparation of plant-growth inhibitors
- Michael addition reactions
- Synthesis of cyclooxygenase-1 (COX-1)/cyclooxygenase-2 (COX-2) inhibitors
Signal Word
Warning
Hazard Statements
Precautionary Statements
Hazard Classifications
Acute Tox. 4 Oral
Storage Class Code
11 - Combustible Solids
WGK
WGK 3
Flash Point(F)
285.8 °F
Flash Point(C)
141 °C
Personal Protective Equipment
dust mask type N95 (US), Eyeshields, Gloves
Certificates of Analysis (COA)
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