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10130-89-9,MFCD00007448
Catalog No.:AA00043O
10130-89-9 | 4-(Chlorosulfonyl)benzoic acid
Pack Size
Purity
Availability
Price(USD)
Quantity
  
1g
95%
in stock  
$11.00   $8.00
- +
25g
95%
in stock  
$137.00   $96.00
- +
  • Technical Information
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  • Literature
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  • Technical Information
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Technical Information
Catalog Number:
AA00043O
Chemical Name:
4-(Chlorosulfonyl)benzoic acid
CAS Number:
10130-89-9
Molecular Formula:
C7H5ClO4S
Molecular Weight:
220.6302
MDL Number:
MFCD00007448
IUPAC Name:
4-chlorosulfonylbenzoic acid
InChI:
InChI=1S/C7H5ClO4S/c8-13(11,12)6-3-1-5(2-4-6)7(9)10/h1-4H,(H,9,10)
InChI Key:
PTCSSXYPZOFISK-UHFFFAOYSA-N
SMILES:
OC(=O)c1ccc(cc1)S(=O)(=O)Cl
EC Number:
233-367-2
Properties
Computed Properties
 
Complexity:
284  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
219.96g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
220.623g/mol
Monoisotopic Mass:
219.96g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
79.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5  

Synonyms
 
4-(Chlorosulfonyl)benzoic acid 
10130-89-9 
4-Chlorosulfonyl-benzoic acid 
PTCSSXYPZOFISK-UHFFFAOYSA-N 
4-(Chlorosulfonyl)benzoic acid, 96% 
4-carboxy-benzenesulfonylchloride 
EINECS 233-367-2 
NSC 191087 
PubChem14811 
akos bb-9471 
ACMC-1BROT 
rarechem al bo 0540 
Benzoic acid, 4-(chlorosulfonyl)- 
AC1Q6YLP 
p-chlorosulfonylbenzoic acid 
(chlorosulfonyl)benzoic acid 
AC1L33AY 
4-chlorosulphonylbenzoic acid 
SCHEMBL40244 
4-Chlorosulfonyl benzoic acid 
KSC493I0D 
4-(chlorosulfonyl)-benzoicaci 
4-chloranylsulfonylbenzoic acid 
4-chlorosulfonylbenzoic acid 
4-chlorosulphonyl benzoic acid 
4-chlorosulphonyl-benzoic acid 
4-carboxyphenylsulphonylchloride 
AC1Q737V 
otava-bb bb7020430958 
4-(chlorosulfonyl) benzoic acid 
4-(chlorosulfonyl)-benzoic acid 
DTXSID5064960 
CTK3J3401 
PTCSSXYPZOFISK-UHFFFAOYSA- 
4-(Chlorosulphonyl)benzoic acid 
4-(chlorosulphonyl) benzoic acid 
ACN-P000613 
ANW-56717 
BBL011143 
NSC191087 
NSC511364 
SBB016763 
STK802455 
ZINC59796783 
AKOS000349033 
p-(Chlorosulfonyl)benzoic acid 
AC-7117 
AN-9318 
CS-W019499 
MCULE-1842819262 
NSC-191087 
NSC-511364 
RP05176 
TRA-0205217 
AK-44953 
AS-19759 
p-Carboxybenzenesulfonyl chloride 
SC-25419 
DB-037935 
RT-001444 
ST2418014 
BB 0218015 
FT-0636637 
ST45243662 
Y6787 
EN300-17765 
KS-00000106 
Benzoic acid, p-(chlorosulfonyl)- 
M-7390 
37439-EP2311802A1 
37439-EP2311803A1 
130C899 
A800370 
I09-1028 
J-513707 
InChI=1/C7H5ClO4S/c8-13(11,12)6-3-1-5(2-4-6)7(9)10/h1-4H,(H,9,10) 
C7H5ClO4S 
C7-H5-Cl-O4-S 
4-Carboxybenzenesulfonyl chloride 
CID82385 
AR-1F6790 
ACN-000613 
4-(Chlorosulfonyl)benzoic acid, 96% - 1G 1g 
10173-74-7 
MFCD00007448 
Literature

Title: Activation of sulfonate ester based matrix metalloproteinase proinhibitors by hydrogen peroxide.

Journal: Journal of biological inorganic chemistry : JBIC : a publication of the Society of Biological Inorganic Chemistry 20110201

Title: Carbonic anhydrase inhibitors: topically acting antiglaucoma sulfonamides incorporating esters and amides of 3- and 4-carboxybenzolamide.

Journal: Bioorganic & medicinal chemistry letters 20030901

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