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Home > Indoles and Oxindole > 359811-06-6
359811-06-6 | 2-(3-nitrophenyl)isoindoline
CAS No: 359811-06-6 Catalog No: AG00JGO5 MDL No:MFCD02940747
Product Description
Catalog Number:
AG00JGO5
Chemical Name:
2-(3-nitrophenyl)isoindoline
CAS Number:
359811-06-6
Molecular Formula:
C14H12N2O2
Molecular Weight:
240.2573
MDL Number:
MFCD02940747
IUPAC Name:
2-(3-nitrophenyl)-1,3-dihydroisoindole
InChI:
InChI=1S/C14H12N2O2/c17-16(18)14-7-3-6-13(8-14)15-9-11-4-1-2-5-12(11)10-15/h1-8H,9-10H2
InChI Key:
KGTVGOAEWDYWLH-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1cccc(c1)N1Cc2c(C1)cccc2
Properties
Complexity:
301
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
240.09g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
240.262g/mol
Monoisotopic Mass:
240.09g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
49.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9
Literature
| Title | Journal |
|---|---|
| Microsphere-based protease assays and screening application for lethal factor and factor Xa. | Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501 |
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