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1141-05-5 | 1,2-Ethanediol, 1,2-di-2-pyridinyl-
CAS No: 1141-05-5 Catalog No: AG000AKL MDL No:
Product Description
Catalog Number:
AG000AKL
Chemical Name:
1,2-Ethanediol, 1,2-di-2-pyridinyl-
CAS Number:
1141-05-5
Molecular Formula:
C12H12N2O2
Molecular Weight:
216.2359
IUPAC Name:
1,2-dipyridin-2-ylethane-1,2-diol
InChI:
InChI=1S/C12H12N2O2/c15-11(9-5-1-3-7-13-9)12(16)10-6-2-4-8-14-10/h1-8,11-12,15-16H
InChI Key:
HVIBJFDEUPZPPC-UHFFFAOYSA-N
SMILES:
OC(C(c1ccccn1)O)c1ccccn1
EC Number:
214-524-4
NSC Number:
16409
Properties
Complexity:
191
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
216.09g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
216.24g/mol
Monoisotopic Mass:
216.09g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
66.2A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.2
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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