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206055-84-7 | 5-Isoxazolemethanol, 4,5-dihydro-3-(4-methoxyphenyl)-
CAS No: 206055-84-7 Catalog No: AG002AI4 MDL No:MFCD11983410
Product Description
Catalog Number:
AG002AI4
Chemical Name:
5-Isoxazolemethanol, 4,5-dihydro-3-(4-methoxyphenyl)-
CAS Number:
206055-84-7
Molecular Formula:
C11H13NO3
Molecular Weight:
207.2258
MDL Number:
MFCD11983410
IUPAC Name:
[3-(4-methoxyphenyl)-4,5-dihydro-1,2-oxazol-5-yl]methanol
InChI:
InChI=1S/C11H13NO3/c1-14-9-4-2-8(3-5-9)11-6-10(7-13)15-12-11/h2-5,10,13H,6-7H2,1H3
InChI Key:
VLLYRDLFJWFLGB-UHFFFAOYSA-N
SMILES:
OCC1ON=C(C1)c1ccc(cc1)OC
Properties
Complexity:
234
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
207.09g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
207.229g/mol
Monoisotopic Mass:
207.09g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
51A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1
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