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84807-26-1

84807-26-1 | 4-Nitro-2,3-dihydro-1H-indole

CAS No: 84807-26-1 Catalog No: AG0036FF MDL No:MFCD07371624

Product Description

Catalog Number:
AG0036FF
Chemical Name:
4-Nitro-2,3-dihydro-1H-indole
CAS Number:
84807-26-1
Molecular Formula:
C8H8N2O2
Molecular Weight:
164.1613
MDL Number:
MFCD07371624
IUPAC Name:
4-nitro-2,3-dihydro-1H-indole
InChI:
InChI=1S/C8H8N2O2/c11-10(12)8-3-1-2-7-6(8)4-5-9-7/h1-3,9H,4-5H2
InChI Key:
VTQFDUKXUFJCAO-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1cccc2c1CCN2

Properties

Complexity:
190  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
164.059g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
164.164g/mol
Monoisotopic Mass:
164.059g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
57.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8  

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