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57148-90-0

57148-90-0 | 2-(BENZO[D]ISOXAZOL-3-YL)ETHANOL

CAS No: 57148-90-0 Catalog No: AG00EBYI MDL No:MFCD08236835

Product Description

Catalog Number:
AG00EBYI
Chemical Name:
2-(BENZO[D]ISOXAZOL-3-YL)ETHANOL
CAS Number:
57148-90-0
Molecular Formula:
C9H9NO2
Molecular Weight:
163.1733
MDL Number:
MFCD08236835
IUPAC Name:
2-(1,2-benzoxazol-3-yl)ethanol
InChI:
InChI=1S/C9H9NO2/c11-6-5-8-7-3-1-2-4-9(7)12-10-8/h1-4,11H,5-6H2
InChI Key:
CYKKOJQAYUCNGO-UHFFFAOYSA-N
SMILES:
OCCc1noc2c1cccc2

Properties

Complexity:
152  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
163.063g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
163.176g/mol
Monoisotopic Mass:
163.063g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
46.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3  

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