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1199773-18-6

1199773-18-6 | Benzenesulfonic acid, 2,4,6-trimethyl-, 2-(1,4-dioxaspiro[4.5]dec-8-ylidene)hydrazide

CAS No: 1199773-18-6 Catalog No: AG000PXO MDL No:MFCD13195684

Product Description

Catalog Number:
AG000PXO
Chemical Name:
Benzenesulfonic acid, 2,4,6-trimethyl-, 2-(1,4-dioxaspiro[4.5]dec-8-ylidene)hydrazide
CAS Number:
1199773-18-6
Molecular Formula:
C17H24N2O4S
Molecular Weight:
352.4485
MDL Number:
MFCD13195684
IUPAC Name:
N-(1,4-dioxaspiro[4.5]decan-8-ylideneamino)-2,4,6-trimethylbenzenesulfonamide
InChI:
InChI=1S/C17H24N2O4S/c1-12-10-13(2)16(14(3)11-12)24(20,21)19-18-15-4-6-17(7-5-15)22-8-9-23-17/h10-11,19H,4-9H2,1-3H3
InChI Key:
USQCRRQVCMGNMM-UHFFFAOYSA-N
SMILES:
Cc1cc(C)cc(c1S(=O)(=O)NN=C1CCC2(CC1)OCCO2)C

Properties

Complexity:
554  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
352.146g/mol
Formal Charge:
0
Heavy Atom Count:
24  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
352.449g/mol
Monoisotopic Mass:
352.146g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
85.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1  

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