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345967-78-4 | [3-(2-METHOXY-PHENYL)-ISOXAZOL-5-YL]-METHANOL
CAS No: 345967-78-4 Catalog No: AG00BYVV MDL No:MFCD06738511
Product Description
Catalog Number:
AG00BYVV
Chemical Name:
[3-(2-METHOXY-PHENYL)-ISOXAZOL-5-YL]-METHANOL
CAS Number:
345967-78-4
Molecular Formula:
C11H11NO3
Molecular Weight:
205.2099
MDL Number:
MFCD06738511
IUPAC Name:
[3-(2-methoxyphenyl)-1,2-oxazol-5-yl]methanol
InChI:
InChI=1S/C11H11NO3/c1-14-11-5-3-2-4-9(11)10-6-8(7-13)15-12-10/h2-6,13H,7H2,1H3
InChI Key:
XYPGDMUIGARFDK-UHFFFAOYSA-N
SMILES:
COc1ccccc1c1noc(c1)CO
Properties
Complexity:
200
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
205.074g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
205.213g/mol
Monoisotopic Mass:
205.074g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
55.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2
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