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198021-41-9 | 3-Oxazolidineacetyl chloride, 2-oxo-4,5-diphenyl-, (4S,5R)-
CAS No: 198021-41-9 Catalog No: AG002B8U MDL No:
Product Description
Catalog Number:
AG002B8U
Chemical Name:
3-Oxazolidineacetyl chloride, 2-oxo-4,5-diphenyl-, (4S,5R)-
CAS Number:
198021-41-9
Molecular Formula:
C17H14ClNO3
Molecular Weight:
315.7510
IUPAC Name:
2-[(4S,5R)-2-oxo-4,5-diphenyl-1,3-oxazolidin-3-yl]acetyl chloride
InChI:
InChI=1S/C17H14ClNO3/c18-14(20)11-19-15(12-7-3-1-4-8-12)16(22-17(19)21)13-9-5-2-6-10-13/h1-10,15-16H,11H2/t15-,16+/m0/s1
InChI Key:
ONCPUTDNWCACRL-JKSUJKDBSA-N
SMILES:
ClC(=O)CN1C(=O)O[C@@H]([C@@H]1c1ccccc1)c1ccccc1
Properties
Complexity:
416
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
2
Defined Bond Stereocenter Count:
0
Exact Mass:
315.066g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
315.753g/mol
Monoisotopic Mass:
315.066g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
46.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5
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