Home Carbonyls 3-cyclopropanecarbonyl-5-nitro-1H-indole

3-cyclopropanecarbonyl-5-nitro-1H-indole

CAS No.:
1094681-83-0
Catalog Number:
AG01ACE1
Molecular Formula:
C12H10N2O3
Molecular Weight:
230.2194
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Product Description
Catalog Number:
AG01ACE1
Chemical Name:
3-cyclopropanecarbonyl-5-nitro-1H-indole
CAS Number:
1094681-83-0
Molecular Formula:
C12H10N2O3
Molecular Weight:
230.2194
MDL Number:
MFCD11211546
IUPAC Name:
cyclopropyl-(5-nitro-1H-indol-3-yl)methanone
InChI:
InChI=1S/C12H10N2O3/c15-12(7-1-2-7)10-6-13-11-4-3-8(14(16)17)5-9(10)11/h3-7,13H,1-2H2
InChI Key:
XUWVQZIMPRHPLD-UHFFFAOYSA-N
SMILES:
O=C(c1c[nH]c2c1cc(cc2)[N+](=O)[O-])C1CC1
Properties
Complexity:
348  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
230.069g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
230.223g/mol
Monoisotopic Mass:
230.069g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
78.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2  
Properties