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56542-61-1 | 3-cyano-N-ethylbenzene-1-sulfonamide
CAS No: 56542-61-1 Catalog No: AG01C1NN MDL No:MFCD08884392
Product Description
Catalog Number:
AG01C1NN
Chemical Name:
3-cyano-N-ethylbenzene-1-sulfonamide
CAS Number:
56542-61-1
Molecular Formula:
C9H10N2O2S
Molecular Weight:
210.2529
MDL Number:
MFCD08884392
IUPAC Name:
3-cyano-N-ethylbenzenesulfonamide
InChI:
InChI=1S/C9H10N2O2S/c1-2-11-14(12,13)9-5-3-4-8(6-9)7-10/h3-6,11H,2H2,1H3
InChI Key:
CTEVGKCGQHFCTE-UHFFFAOYSA-N
SMILES:
CCNS(=O)(=O)c1cccc(c1)C#N
Properties
Complexity:
323
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
210.046g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
210.251g/mol
Monoisotopic Mass:
210.046g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
78.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1
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