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16365-26-7 | Ethanol, 2-(3-nitrophenoxy)-
CAS No: 16365-26-7 Catalog No: AG001UAR MDL No:MFCD00463498
Product Description
Catalog Number:
AG001UAR
Chemical Name:
Ethanol, 2-(3-nitrophenoxy)-
CAS Number:
16365-26-7
Molecular Formula:
C8H9NO4
Molecular Weight:
183.1614
MDL Number:
MFCD00463498
IUPAC Name:
2-(3-nitrophenoxy)ethanol
InChI:
InChI=1S/C8H9NO4/c10-4-5-13-8-3-1-2-7(6-8)9(11)12/h1-3,6,10H,4-5H2
InChI Key:
GPYPMRCKTUAVQI-UHFFFAOYSA-N
SMILES:
OCCOc1cccc(c1)[N+](=O)[O-]
Properties
Complexity:
168
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
183.053g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
183.163g/mol
Monoisotopic Mass:
183.053g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
75.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5
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