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4-chloro-3-sulfamoylbenzoyl chloride

4-chloro-3-sulfamoylbenzoyl chloride

CAS: 70049-77-3

Formula: C7H5Cl2NO3S

SMILES: NS(=O)(=O)C1=C(Cl)C=CC(=C1)C(Cl)=O

IUPAC: 4-chloro-3-sulfamoylbenzoyl chloride

InChI: InChI=1S/C7H5Cl2NO3S/c8-5-2-1-4(7(9)11)3-6(5)14(10,12)13/h1-3H,(H2,10,12,13)

Composition: C (33.09%), H (1.98%), Cl (27.90%), N (5.51%), O (18.89%), S (12.62%)

Molar Mass: 254.08

Atom Count: 19

Heavy Atom Count: 14

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 252.9367196
Formal Charge 0
FSP3 0
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 1
InChIKey SCYSJFKWFQZRJW-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 54.14
Topological Polar Surface Area 77.23
Polarizability 21.49
Ring Count 1
Rotatable Bond Count 2

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Purity LeadTime CAS UnitPrice
98% <14 Days 70049-77-3 Quote Only
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Purity LeadTime CAS PacketSize UnitPrice
97% <14 Days 70049-77-3 $38.76-$273.36$38.76$71.40$273.36
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