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About This Item
Empirical Formula (Hill Notation):
C9H7NO2
CAS Number:
Molecular Weight:
161.16
UNSPSC Code:
12352100
NACRES:
NA.22
PubChem Substance ID:
EC Number:
216-030-4
Beilstein/REAXYS Number:
124132
MDL number:
Assay:
98%
Quality Segment
assay
98%
mp
202-206 °C (lit.)
SMILES string
OC(=O)c1cc2ccccc2[nH]1
InChI
1S/C9H7NO2/c11-9(12)8-5-6-3-1-2-4-7(6)10-8/h1-5,10H,(H,11,12)
InChI key
HCUARRIEZVDMPT-UHFFFAOYSA-N
Gene Information
human ... SRD5A1(6715)
rat ... Grin2a(24409)
Application
- Reactant for total synthesis of (±)-dibromophakellin and analogs
- Reactant for synthesis of the pyrrolizidine alkaloid (±)-trachelanthamidine
- Reactant for stereoselective preparation of renieramycin G analogs
- Reactant for preparation of spirooxoindolepyrrolidines via reduction of indole-2-carboxylic acid followed by oxidation, condensation, reduction, amidation and Kharasch radical cyclization
- Reactant for Pd-catalyzed cyclization
- Reactant for preparation of N,N′-(pentane)diylbis[indolecarboxamide] and N,N′-[phenylenebis(methylene)]bis[indolecarboxamide] derivatives
Storage Class
11 - Combustible Solids
flash_point_f
Not applicable
flash_point_c
Not applicable
ppe
Eyeshields, Gloves, type N95 (US)
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