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138647-38-8 | Ethanol, 2-(8-quinolinyloxy)-, dihydrate
CAS No: 138647-38-8 Catalog No: AG006ZYE MDL No:
Product Description
Catalog Number:
AG006ZYE
Chemical Name:
Ethanol, 2-(8-quinolinyloxy)-, dihydrate
CAS Number:
138647-38-8
Molecular Formula:
C11H15NO4
Molecular Weight:
225.2411
IUPAC Name:
2-quinolin-8-yloxyethanol;dihydrate
InChI:
InChI=1S/C11H11NO2.2H2O/c13-7-8-14-10-5-1-3-9-4-2-6-12-11(9)10;;/h1-6,13H,7-8H2;2*1H2
InChI Key:
SREQATCIFWZTRR-UHFFFAOYSA-N
SMILES:
OCCOc1cccc2c1nccc2.O.O
Properties
Complexity:
175
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
225.1g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
225.244g/mol
Monoisotopic Mass:
225.1g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
44.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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