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169378-47-6

169378-47-6 | Methanone, di-4-isoxazolyl- (9CI)

CAS No: 169378-47-6 Catalog No: AG00BA1I MDL No:

Product Description

Catalog Number:
AG00BA1I
Chemical Name:
Methanone, di-4-isoxazolyl- (9CI)
CAS Number:
169378-47-6
IUPAC Name:
bis(1,3-oxazol-4-yl)methanone
InChI:
InChI=1S/C7H4N2O3/c10-7(5-1-11-3-8-5)6-2-12-4-9-6/h1-4H
InChI Key:
PALRZVLQGJKZPD-UHFFFAOYSA-N

Properties

Complexity:
168  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
164.022g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
164.12g/mol
Monoisotopic Mass:
164.022g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
69.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8  

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