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866531-02-4 | [4-methyl-2-(3-methylphenyl)-1,3-oxazol-5-yl]methanol
CAS No: 866531-02-4 Catalog No: AG01BOZO MDL No:MFCD30499744
Product Description
Catalog Number:
AG01BOZO
Chemical Name:
[4-methyl-2-(3-methylphenyl)-1,3-oxazol-5-yl]methanol
CAS Number:
866531-02-4
Molecular Formula:
C12H13NO2
Molecular Weight:
203.2371
MDL Number:
MFCD30499744
IUPAC Name:
[4-methyl-2-(3-methylphenyl)-1,3-oxazol-5-yl]methanol
InChI:
InChI=1S/C12H13NO2/c1-8-4-3-5-10(6-8)12-13-9(2)11(7-14)15-12/h3-6,14H,7H2,1-2H3
InChI Key:
PESNUNAHBYLDOW-UHFFFAOYSA-N
SMILES:
OCc1oc(nc1C)c1cccc(c1)C
Properties
Complexity:
210
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
203.095g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
203.241g/mol
Monoisotopic Mass:
203.095g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
46.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
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