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89130-06-3 | Phenol, 4-methoxy-2-[(5-methyl-3-isoxazolyl)azo]-
CAS No: 89130-06-3 Catalog No: AG003XSE MDL No:
Product Description
Catalog Number:
AG003XSE
Chemical Name:
Phenol, 4-methoxy-2-[(5-methyl-3-isoxazolyl)azo]-
CAS Number:
89130-06-3
Molecular Formula:
C11H11N3O3
Molecular Weight:
233.2233
IUPAC Name:
4-methoxy-2-[(5-methyl-1,2-oxazol-3-yl)diazenyl]phenol
InChI:
InChI=1S/C11H11N3O3/c1-7-5-11(14-17-7)13-12-9-6-8(16-2)3-4-10(9)15/h3-6,15H,1-2H3
InChI Key:
UQQVBYQHOXAHKD-UHFFFAOYSA-N
SMILES:
COc1ccc(c(c1)N=Nc1noc(c1)C)O
Properties
Complexity:
275
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
233.08g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
233.227g/mol
Monoisotopic Mass:
233.08g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
80.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
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