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24207-30-5 | 1,3-Benzenediol, 5-(4,5-dihydro-2-oxazolyl)-
CAS No: 24207-30-5 Catalog No: AG006X5F MDL No:
Product Description
Catalog Number:
AG006X5F
Chemical Name:
1,3-Benzenediol, 5-(4,5-dihydro-2-oxazolyl)-
CAS Number:
24207-30-5
Molecular Formula:
C9H9NO3
Molecular Weight:
179.1727
IUPAC Name:
5-(4,5-dihydro-1,3-oxazol-2-yl)benzene-1,3-diol
InChI:
InChI=1S/C9H9NO3/c11-7-3-6(4-8(12)5-7)9-10-1-2-13-9/h3-5,11-12H,1-2H2
InChI Key:
VHUUJNOGGSRIEV-UHFFFAOYSA-N
SMILES:
Oc1cc(O)cc(c1)C1=NCCO1
Properties
Complexity:
207
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
179.058g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
179.175g/mol
Monoisotopic Mass:
179.058g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
62A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7
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