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Home > Indoles and Oxindole > 1692027-77-2
1692027-77-2 | 7-nitro-3-(propan-2-yl)-2,3-dihydro-1H-indole
CAS No: 1692027-77-2 Catalog No: AG01BP6F MDL No:MFCD30499922
Product Description
Catalog Number:
AG01BP6F
Chemical Name:
7-nitro-3-(propan-2-yl)-2,3-dihydro-1H-indole
CAS Number:
1692027-77-2
Molecular Formula:
C11H14N2O2
Molecular Weight:
206.2411
MDL Number:
MFCD30499922
IUPAC Name:
7-nitro-3-propan-2-yl-2,3-dihydro-1H-indole
InChI:
InChI=1S/C11H14N2O2/c1-7(2)9-6-12-11-8(9)4-3-5-10(11)13(14)15/h3-5,7,9,12H,6H2,1-2H3
InChI Key:
KMTDIOJPLANYOT-UHFFFAOYSA-N
SMILES:
CC(C1CNc2c1cccc2[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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