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Home > Indoles and Oxindole > 1701713-19-0
1701713-19-0 | 3-ethyl-7-nitro-2,3-dihydro-1H-indole
CAS No: 1701713-19-0 Catalog No: AG01BP6H MDL No:MFCD30499924
Product Description
Catalog Number:
AG01BP6H
Chemical Name:
3-ethyl-7-nitro-2,3-dihydro-1H-indole
CAS Number:
1701713-19-0
Molecular Formula:
C10H12N2O2
Molecular Weight:
192.2145
MDL Number:
MFCD30499924
IUPAC Name:
3-ethyl-7-nitro-2,3-dihydro-1H-indole
InChI:
InChI=1S/C10H12N2O2/c1-2-7-6-11-10-8(7)4-3-5-9(10)12(13)14/h3-5,7,11H,2,6H2,1H3
InChI Key:
VMYFDLQICQRSLI-UHFFFAOYSA-N
SMILES:
CCC1CNc2c1cccc2[N+](=O)[O-]
Properties
Complexity:
227
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
192.09g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
192.218g/mol
Monoisotopic Mass:
192.09g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
57.8A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
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