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885274-04-4 | (2-O-TOLYL-OXAZOL-4-YL)-METHANOL
CAS No: 885274-04-4 Catalog No: AG00GS29 MDL No:MFCD06738647
Product Description
Catalog Number:
AG00GS29
Chemical Name:
(2-O-TOLYL-OXAZOL-4-YL)-METHANOL
CAS Number:
885274-04-4
Molecular Formula:
C11H11NO2
Molecular Weight:
189.2105
MDL Number:
MFCD06738647
IUPAC Name:
[2-(2-methylphenyl)-1,3-oxazol-4-yl]methanol
InChI:
InChI=1S/C11H11NO2/c1-8-4-2-3-5-10(8)11-12-9(6-13)7-14-11/h2-5,7,13H,6H2,1H3
InChI Key:
HDQIBOILSFYROR-UHFFFAOYSA-N
SMILES:
OCc1coc(n1)c1ccccc1C
Properties
Complexity:
186
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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