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586-96-9

586-96-9 | Nitrosobenzene

CAS No: 586-96-9 Catalog No: AG003A0P MDL No:MFCD00002059

Product Description

Catalog Number:
AG003A0P
Chemical Name:
Nitrosobenzene
CAS Number:
586-96-9
Molecular Formula:
C6H5NO
Molecular Weight:
107.1100
MDL Number:
MFCD00002059
IUPAC Name:
nitrosobenzene
InChI:
InChI=1S/C6H5NO/c8-7-6-4-2-1-3-5-6/h1-5H
InChI Key:
NLRKCXQQSUWLCH-UHFFFAOYSA-N
SMILES:
O=Nc1ccccc1
EC Number:
209-591-1
UNII:
ZI9W9E8G2Z
NSC Number:
66479

Properties

Complexity:
76.6  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
107.037g/mol
Formal Charge:
0
Heavy Atom Count:
8  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
107.112g/mol
Monoisotopic Mass:
107.037g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
29.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2  

Literature

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