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61348-47-8 | 2-(5-ISOXAZOLYL)PHENOL
CAS No: 61348-47-8 Catalog No: AG00EA1T MDL No:MFCD00218653
Product Description
Catalog Number:
AG00EA1T
Chemical Name:
2-(5-ISOXAZOLYL)PHENOL
CAS Number:
61348-47-8
Molecular Formula:
C9H7NO2
Molecular Weight:
161.1574
MDL Number:
MFCD00218653
IUPAC Name:
2-(1,2-oxazol-5-yl)phenol
InChI:
InChI=1S/C9H7NO2/c11-8-4-2-1-3-7(8)9-5-6-10-12-9/h1-6,11H
InChI Key:
DBDXTIAEVFSDNN-UHFFFAOYSA-N
SMILES:
Oc1ccccc1c1ccno1
Properties
Complexity:
152
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
161.048g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
161.16g/mol
Monoisotopic Mass:
161.048g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
46.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7
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