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Home > Indoles and Oxindole > 1698281-35-4
1698281-35-4 | 5-nitro-3-(propan-2-yl)-2,3-dihydro-1H-indole
CAS No: 1698281-35-4 Catalog No: AG01BP5X MDL No:MFCD30499912
Product Description
Catalog Number:
AG01BP5X
Chemical Name:
5-nitro-3-(propan-2-yl)-2,3-dihydro-1H-indole
CAS Number:
1698281-35-4
Molecular Formula:
C11H14N2O2
Molecular Weight:
206.2411
MDL Number:
MFCD30499912
IUPAC Name:
5-nitro-3-propan-2-yl-2,3-dihydro-1H-indole
InChI:
InChI=1S/C11H14N2O2/c1-7(2)10-6-12-11-4-3-8(13(14)15)5-9(10)11/h3-5,7,10,12H,6H2,1-2H3
InChI Key:
AHXXQQPGLIPAAA-UHFFFAOYSA-N
SMILES:
CC(C1CNc2c1cc(cc2)[N+](=O)[O-])C
Properties
Complexity:
250
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
206.106g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
206.245g/mol
Monoisotopic Mass:
206.106g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
57.8A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9
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