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(2E)-2-(4-chlorobenzenesulfonyl)-3-hydrazinylprop-2-enenitrile

(2E)-2-(4-chlorobenzenesulfonyl)-3-hydrazinylprop-2-enenitrile

CAS: 68342-62-1

Formula: C9H8ClN3O2S

SMILES: NNC=C(/C#N)S(=O)(=O)C1=CC=C(Cl)C=C1

IUPAC: (2E)-2-(4-chlorobenzenesulfonyl)-3-hydrazinylprop-2-enenitrile

InChI: InChI=1S/C9H8ClN3O2S/c10-7-1-3-8(4-2-7)16(14,15)9(5-11)6-13-12/h1-4,6,13H,12H2/b9-6+

Composition: C (41.95%), H (3.13%), Cl (13.76%), N (16.31%), O (12.42%), S (12.44%)

Molar Mass: 257.69

Atom Count: 24

Heavy Atom Count: 16

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 257.0025754
Formal Charge 0
FSP3 0
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 5
Hydrogen Bond Donor Count 2
InChIKey WHBWKRCZOFCUPG-RMKNXTFCSA-N
Lipinski's Rule of Five 1
Molar Refractivity 73.21
Topological Polar Surface Area 95.98
Polarizability 24.12
Ring Count 1
Rotatable Bond Count 3

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95% <5 Days 68342-62-1 $1,960.00-$3,960.00$1,960.00$2,860.00$3,960.00
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