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Home > Indoles and Oxindole > 885-12-1
885-12-1 | 2-(1H-Pyrrol-1-yl)isoindoline-1,3-dione
CAS No: 885-12-1 Catalog No: AG00489I MDL No:MFCD00837647
Product Description
Catalog Number:
AG00489I
Chemical Name:
2-(1H-Pyrrol-1-yl)isoindoline-1,3-dione
CAS Number:
885-12-1
Molecular Formula:
C12H8N2O2
Molecular Weight:
212.2041
MDL Number:
MFCD00837647
IUPAC Name:
2-pyrrol-1-ylisoindole-1,3-dione
InChI:
InChI=1S/C12H8N2O2/c15-11-9-5-1-2-6-10(9)12(16)14(11)13-7-3-4-8-13/h1-8H
InChI Key:
ZNEDESIYADUHFJ-UHFFFAOYSA-N
SMILES:
O=C1c2ccccc2C(=O)N1n1cccc1
Properties
Complexity:
299
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
212.059g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
212.208g/mol
Monoisotopic Mass:
212.059g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
42.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2
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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