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640291-93-6 | (5-P-TOLYLISOXAZOL-3-YL)METHANOL
CAS No: 640291-93-6 Catalog No: AG00EDU6 MDL No:MFCD06199339
Product Description
Catalog Number:
AG00EDU6
Chemical Name:
(5-P-TOLYLISOXAZOL-3-YL)METHANOL
CAS Number:
640291-93-6
Molecular Formula:
C11H11NO2
Molecular Weight:
189.2105
MDL Number:
MFCD06199339
IUPAC Name:
[5-(4-methylphenyl)-1,2-oxazol-3-yl]methanol
InChI:
InChI=1S/C11H11NO2/c1-8-2-4-9(5-3-8)11-6-10(7-13)12-14-11/h2-6,13H,7H2,1H3
InChI Key:
YPDITGIFBYDNAC-UHFFFAOYSA-N
SMILES:
OCc1noc(c1)c1ccc(cc1)C
Properties
Complexity:
178
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
189.079g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
189.214g/mol
Monoisotopic Mass:
189.079g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
46.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5
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