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30817-36-8 | Benzaldehyde, 4-[2-(4-morpholinyl)-2-oxoethoxy]-
CAS No: 30817-36-8 Catalog No: AG0031E2 MDL No:MFCD04084440
Product Description
Catalog Number:
AG0031E2
Chemical Name:
Benzaldehyde, 4-[2-(4-morpholinyl)-2-oxoethoxy]-
CAS Number:
30817-36-8
Molecular Formula:
C13H15NO4
Molecular Weight:
249.2625
MDL Number:
MFCD04084440
IUPAC Name:
4-(2-morpholin-4-yl-2-oxoethoxy)benzaldehyde
InChI:
InChI=1S/C13H15NO4/c15-9-11-1-3-12(4-2-11)18-10-13(16)14-5-7-17-8-6-14/h1-4,9H,5-8,10H2
InChI Key:
KHQZOOBUOHUYHO-UHFFFAOYSA-N
SMILES:
O=Cc1ccc(cc1)OCC(=O)N1CCOCC1
Properties
Complexity:
281
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
249.1g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
249.266g/mol
Monoisotopic Mass:
249.1g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
55.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.2
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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