Name: Name:3-cyclobutanecarbonyl-5-nitro-1H-indole
Brand: Angene
SKU: AG01AC7U
Rating: 90 (10 reviews)

3-cyclobutanecarbonyl-5-nitro-1H-indole

CAS No.:

1097117-03-7

Catalog Number:

AG01AC7U

Molecular Formula:

C13H12N2O3

Molecular Weight:

244.2460

Catalog Number:

AG01AC7U

Chemical Name:

3-cyclobutanecarbonyl-5-nitro-1H-indole

CAS Number:

1097117-03-7

Molecular Formula:

C13H12N2O3

Molecular Weight:

244.2460

MDL Number:

MFCD11545710

IUPAC Name:

cyclobutyl-(5-nitro-1H-indol-3-yl)methanone

InChI:

InChI=1S/C13H12N2O3/c16-13(8-2-1-3-8)11-7-14-12-5-4-9(15(17)18)6-10(11)12/h4-8,14H,1-3H2

InChI Key:

RQBQQGUJDFPLOP-UHFFFAOYSA-N

SMILES:

O=C(c1c[nH]c2c1cc(cc2)[N+](=O)[O-])C1CCC1

Complexity:

362

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

244.085g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

244.25g/mol

Monoisotopic Mass:

244.085g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

78.7A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.6