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2-acetamido-2,3-dihydro-1H-indene-5-sulfonyl chloride

2-acetamido-2,3-dihydro-1H-indene-5-sulfonyl chloride

CAS: 74124-92-8

Formula: C11H12ClNO3S

SMILES: CC(=O)NC1CC2=C(C1)C=C(C=C2)S(Cl)(=O)=O

IUPAC: 2-acetamido-2,3-dihydro-1H-indene-5-sulfonyl chloride

InChI: InChI=1/C11H12ClNO3S/c1-7(14)13-10-4-8-2-3-11(17(12,15)16)6-9(8)5-10/h2-3,6,10H,4-5H2,1H3,(H,13,14)

Composition: C (48.27%), H (4.42%), Cl (12.95%), N (5.12%), O (17.53%), S (11.71%)

Molar Mass: 273.73

Atom Count: 29

Heavy Atom Count: 17

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 1
Exact Mass 273.0226421
Formal Charge 0
FSP3 0.36
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 1
InChIKey XNVZUBLWWSTORI-UHFFFAOYNA-N
Lipinski's Rule of Five 1
Molar Refractivity 65.9
Topological Polar Surface Area 63.24
Polarizability 26.11
Ring Count 2
Rotatable Bond Count 2

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