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82849-43-2

82849-43-2 | 3H-Diazirine, 3-chloro-3-phenoxy-

CAS No: 82849-43-2 Catalog No: AG004WJW MDL No:

Product Description

Catalog Number:
AG004WJW
Chemical Name:
3H-Diazirine, 3-chloro-3-phenoxy-
CAS Number:
82849-43-2
Molecular Formula:
C7H5ClN2O
Molecular Weight:
168.5804
IUPAC Name:
3-chloro-3-phenoxydiazirine
InChI:
InChI=1S/C7H5ClN2O/c8-7(9-10-7)11-6-4-2-1-3-5-6/h1-5H
InChI Key:
UQIBSMLVIOIRHH-UHFFFAOYSA-N
SMILES:
ClC1(N=N1)Oc1ccccc1

Properties

Complexity:
171  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
168.009g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
168.58g/mol
Monoisotopic Mass:
168.009g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
34A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6  

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