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15263-20-4 | tert-Butyl (1,3-dioxoisoindolin-2-yl) carbonate
CAS No: 15263-20-4 Catalog No: AG003OPK MDL No:MFCD00005889
Product Description
Catalog Number:
AG003OPK
Chemical Name:
tert-Butyl (1,3-dioxoisoindolin-2-yl) carbonate
CAS Number:
15263-20-4
Molecular Formula:
C13H13NO5
Molecular Weight:
263.2460
MDL Number:
MFCD00005889
IUPAC Name:
tert-butyl (1,3-dioxoisoindol-2-yl) carbonate
InChI:
InChI=1S/C13H13NO5/c1-13(2,3)18-12(17)19-14-10(15)8-6-4-5-7-9(8)11(14)16/h4-7H,1-3H3
InChI Key:
MCWXBNWFVFOQAS-UHFFFAOYSA-N
SMILES:
O=C(OC(C)(C)C)ON1C(=O)c2c(C1=O)cccc2
EC Number:
239-308-7
Properties
Complexity:
388
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
263.079g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
263.249g/mol
Monoisotopic Mass:
263.079g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
72.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
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