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16180-99-7 | Benzamide, N-[2-(benzoyloxy)ethyl]-
CAS No: 16180-99-7 Catalog No: AG001VWY MDL No:
Product Description
Catalog Number:
AG001VWY
Chemical Name:
Benzamide, N-[2-(benzoyloxy)ethyl]-
CAS Number:
16180-99-7
Molecular Formula:
C16H15NO3
Molecular Weight:
269.2952
IUPAC Name:
2-benzamidoethyl benzoate
InChI:
InChI=1S/C16H15NO3/c18-15(13-7-3-1-4-8-13)17-11-12-20-16(19)14-9-5-2-6-10-14/h1-10H,11-12H2,(H,17,18)
InChI Key:
HMEZXVFFZHPCDN-UHFFFAOYSA-N
SMILES:
O=C(c1ccccc1)NCCOC(=O)c1ccccc1
Properties
Complexity:
318
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
269.105g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
269.3g/mol
Monoisotopic Mass:
269.105g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
55.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7
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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