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169394-70-1

169394-70-1 | 1-(4-(Benzyloxy)phenyl)-2-nitroethanol

CAS No: 169394-70-1 Catalog No: AG00HZB7 MDL No:

Product Description

Catalog Number:
AG00HZB7
Chemical Name:
1-(4-(Benzyloxy)phenyl)-2-nitroethanol
CAS Number:
169394-70-1
IUPAC Name:
2-nitro-1-(4-phenylmethoxyphenyl)ethanol
InChI:
InChI=1S/C15H15NO4/c17-15(10-16(18)19)13-6-8-14(9-7-13)20-11-12-4-2-1-3-5-12/h1-9,15,17H,10-11H2
InChI Key:
NJIXMPVLVNYPBG-UHFFFAOYSA-N

Properties

Complexity:
291  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
273.1g/mol
Formal Charge:
0
Heavy Atom Count:
20  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
273.288g/mol
Monoisotopic Mass:
273.1g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
75.3A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3  

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