2-chloro-1-methanesulfonyl-4-nitrobenzene

2-chloro-1-methanesulfonyl-4-nitrobenzene

CAS: 91842-77-2

Formula: C7H6ClNO4S

SMILES: CS(=O)(=O)C1=C(Cl)C=C(C=C1)[N+]([O-])=O

IUPAC: 2-chloro-1-methanesulfonyl-4-nitrobenzene

InChI: InChI=1S/C7H6ClNO4S/c1-14(12,13)7-3-2-5(9(10)11)4-6(7)8/h2-4H,1H3

Composition: C (35.68%), H (2.57%), Cl (15.04%), N (5.94%), O (27.16%), S (13.61%)

Molar Mass: 235.64

Atom Count: 20

Heavy Atom Count: 14

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	234.9706066
Formal Charge	0
FSP3	0.14
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
InChIKey	DMNZSCLCCLDNPZ-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	51.19
Topological Polar Surface Area	77.28
Polarizability	20.28
Ring Count	1
Rotatable Bond Count	2

Suppliers

AA BLOCKS INC

Supplier Profile

Purity	LeadTime	CAS	PacketSize	UnitPrice
98%	<6 Days	91842-77-2		$16.10-$127.65$16.10$40.25$127.65

Struchem co.,ltd

Supplier Profile

Purity	LeadTime	CAS	PacketSize	UnitPrice
95%	<5 Days	91842-77-2		$1,700.00$1,700.00

MATRIX SCIENTIFIC

Supplier Profile

Purity	LeadTime	CAS	PacketSize	UnitPrice
95%	<2 Days	91842-77-2		$243.85$243.85