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1623-76-3 | 5-Benzofuranol, 2,3-dihydro-3,3-dimethyl-2-(4-morpholinyl)-
CAS No: 1623-76-3 Catalog No: AG001SZA MDL No:MFCD00100124
Product Description
Catalog Number:
AG001SZA
Chemical Name:
5-Benzofuranol, 2,3-dihydro-3,3-dimethyl-2-(4-morpholinyl)-
CAS Number:
1623-76-3
Molecular Formula:
C14H19NO3
Molecular Weight:
249.3056
MDL Number:
MFCD00100124
IUPAC Name:
3,3-dimethyl-2-morpholin-4-yl-2H-1-benzofuran-5-ol
InChI:
InChI=1S/C14H19NO3/c1-14(2)11-9-10(16)3-4-12(11)18-13(14)15-5-7-17-8-6-15/h3-4,9,13,16H,5-8H2,1-2H3
InChI Key:
ACPKVLPHIUATOO-UHFFFAOYSA-N
SMILES:
Oc1ccc2c(c1)C(C)(C)C(O2)N1CCOCC1
Properties
Complexity:
301
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
249.136g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
249.31g/mol
Monoisotopic Mass:
249.136g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
41.9A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
Literature
| Title | Journal |
|---|---|
| Microsphere-based protease assays and screening application for lethal factor and factor Xa. | Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501 |
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