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4-phenylbutane-1-sulfonamide

4-phenylbutane-1-sulfonamide

CAS: 873996-85-1

Formula: C10H15NO2S

SMILES: NS(=O)(=O)CCCCC1=CC=CC=C1

IUPAC: 4-phenylbutane-1-sulfonamide

InChI: InChI=1S/C10H15NO2S/c11-14(12,13)9-5-4-8-10-6-2-1-3-7-10/h1-3,6-7H,4-5,8-9H2,(H2,11,12,13)

Composition: C (56.31%), H (7.09%), N (6.57%), O (15.00%), S (15.03%)

Molar Mass: 213.3

Atom Count: 29

Heavy Atom Count: 14

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 213.082349901
Formal Charge 0
FSP3 0.4
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 1
InChIKey XAIMFSQAEPUOEY-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 56.76
Topological Polar Surface Area 60.16
Polarizability 22.93
Ring Count 1
Rotatable Bond Count 5

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