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101265-24-1 | 4-Isothiocyanato-N,N-dipropylbenzenesulfonamide
CAS No: 101265-24-1 Catalog No: AG00H9GB MDL No:
Product Description
Catalog Number:
AG00H9GB
Chemical Name:
4-Isothiocyanato-N,N-dipropylbenzenesulfonamide
CAS Number:
101265-24-1
IUPAC Name:
4-isothiocyanato-N,N-dipropylbenzenesulfonamide
InChI:
InChI=1S/C13H18N2O2S2/c1-3-9-15(10-4-2)19(16,17)13-7-5-12(6-8-13)14-11-18/h5-8H,3-4,9-10H2,1-2H3
InChI Key:
IWSUGUXJYZFGGX-UHFFFAOYSA-N
Properties
Complexity:
397
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
298.081g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
298.419g/mol
Monoisotopic Mass:
298.081g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
90.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.1
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