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89392-02-9

89392-02-9 | Benzenesulfonamide,2-(1-propyn-1-yl)-

CAS No: 89392-02-9 Catalog No: AG003WB4 MDL No:

Product Description

Catalog Number:
AG003WB4
Chemical Name:
Benzenesulfonamide,2-(1-propyn-1-yl)-
CAS Number:
89392-02-9
Molecular Formula:
C9H9NO2S
Molecular Weight:
195.2383
IUPAC Name:
2-prop-1-ynylbenzenesulfonamide
InChI:
InChI=1S/C9H9NO2S/c1-2-5-8-6-3-4-7-9(8)13(10,11)12/h3-4,6-7H,1H3,(H2,10,11,12)
InChI Key:
RAGRBCPWRFONOD-UHFFFAOYSA-N
SMILES:
CC#Cc1ccccc1S(=O)(=O)N

Properties

Complexity:
328  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
195.035g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
195.236g/mol
Monoisotopic Mass:
195.035g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
68.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2  

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