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Home > Indoles and Oxindole > 1807941-70-3
1807941-70-3 | tert-butyl N-[1-(1,3-dioxo-2,3-dihydro-1H-isoindol-2-yl)hex-4-en-2-yl]carbamate
CAS No: 1807941-70-3 Catalog No: AG01ABU6 MDL No:
Product Description
Catalog Number:
AG01ABU6
Chemical Name:
tert-butyl N-[1-(1,3-dioxo-2,3-dihydro-1H-isoindol-2-yl)hex-4-en-2-yl]carbamate
CAS Number:
1807941-70-3
Molecular Formula:
C19H24N2O4
Molecular Weight:
344.4049
IUPAC Name:
tert-butyl N-[1-(1,3-dioxoisoindol-2-yl)hex-4-en-2-yl]carbamate
InChI:
InChI=1S/C19H24N2O4/c1-5-6-9-13(20-18(24)25-19(2,3)4)12-21-16(22)14-10-7-8-11-15(14)17(21)23/h5-8,10-11,13H,9,12H2,1-4H3,(H,20,24)
InChI Key:
ODUGNRJWKXMSPZ-UHFFFAOYSA-N
SMILES:
CC=CCC(CN1C(=O)c2c(C1=O)cccc2)NC(=O)OC(C)(C)C
Properties
Complexity:
526
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
344.174g/mol
Formal Charge:
0
Heavy Atom Count:
25
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
344.411g/mol
Monoisotopic Mass:
344.174g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
75.7A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
1
XLogP3:
3
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