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866008-78-8 | N-(1-ethynylcyclohexyl)benzenesulfonamide
CAS No: 866008-78-8 Catalog No: AG00IZW3 MDL No:MFCD05670169
Product Description
Catalog Number:
AG00IZW3
Chemical Name:
N-(1-ethynylcyclohexyl)benzenesulfonamide
CAS Number:
866008-78-8
Molecular Formula:
C14H17NO2S
Molecular Weight:
263.3553
MDL Number:
MFCD05670169
IUPAC Name:
N-(1-ethynylcyclohexyl)benzenesulfonamide
InChI:
InChI=1S/C14H17NO2S/c1-2-14(11-7-4-8-12-14)15-18(16,17)13-9-5-3-6-10-13/h1,3,5-6,9-10,15H,4,7-8,11-12H2
InChI Key:
ABMDMJNBOGXWJV-UHFFFAOYSA-N
SMILES:
C#CC1(CCCCC1)NS(=O)(=O)c1ccccc1
Properties
Complexity:
414
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
263.098g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
263.355g/mol
Monoisotopic Mass:
263.098g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
54.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6
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