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861068-37-3

861068-37-3 | 1-(1-Hydroxy-4-nitronaphthalen-2-yl)-2-phenylethanone

CAS No: 861068-37-3 Catalog No: AG01ED43 MDL No:

Product Description

Catalog Number:
AG01ED43
Chemical Name:
1-(1-Hydroxy-4-nitronaphthalen-2-yl)-2-phenylethanone
CAS Number:
861068-37-3
IUPAC Name:
1-(1-hydroxy-4-nitronaphthalen-2-yl)-2-phenylethanone
InChI:
InChI=1S/C18H13NO4/c20-17(10-12-6-2-1-3-7-12)15-11-16(19(22)23)13-8-4-5-9-14(13)18(15)21/h1-9,11,21H,10H2
InChI Key:
JNKRPQPMJYKCNF-UHFFFAOYSA-N

Properties

Complexity:
441  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
307.084g/mol
Formal Charge:
0
Heavy Atom Count:
23  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
307.305g/mol
Monoisotopic Mass:
307.084g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
83.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.5  

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