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2-methyl-6-nitrobenzenesulfonamide

2-methyl-6-nitrobenzenesulfonamide

CAS: 170275-10-2

Formula: C7H8N2O4S

SMILES: CC1=CC=CC(=C1S(N)(=O)=O)[N+]([O-])=O

IUPAC: 2-methyl-6-nitrobenzene-1-sulfonamide

InChI: InChI=1S/C7H8N2O4S/c1-5-3-2-4-6(9(10)11)7(5)14(8,12)13/h2-4H,1H3,(H2,8,12,13)

Composition: C (38.89%), H (3.73%), N (12.96%), O (29.60%), S (14.83%)

Molar Mass: 216.21

Atom Count: 22

Heavy Atom Count: 14

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 216.02047792
Formal Charge 0
FSP3 0.14
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 4
Hydrogen Bond Donor Count 1
InChIKey RBJVDTBCPCLEJF-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 49.58
Topological Polar Surface Area 103.3
Polarizability 19.39
Ring Count 1
Rotatable Bond Count 2

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Purity LeadTime CAS PacketSize UnitPrice
97% <7 Days 170275-10-2 $2,297.30-$7,938.15$2,297.30$2,409.50$2,519.83$2,627.35$2,739.55$7,938.15
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