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18798-43-1

18798-43-1 | 2-Biphenylenol, 3-nitro-

CAS No: 18798-43-1 Catalog No: AG002GM9 MDL No:

Product Description

Catalog Number:
AG002GM9
Chemical Name:
2-Biphenylenol, 3-nitro-
CAS Number:
18798-43-1
Molecular Formula:
C12H7NO3
Molecular Weight:
213.1889
IUPAC Name:
3-nitrobiphenylen-2-ol
InChI:
InChI=1S/C12H7NO3/c14-12-6-10-8-4-2-1-3-7(8)9(10)5-11(12)13(15)16/h1-6,14H
InChI Key:
NJCFOVXTXCIRNT-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1cc2c3ccccc3c2cc1O

Properties

Complexity:
301  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
213.043g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
213.192g/mol
Monoisotopic Mass:
213.043g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
66A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8  

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