Home Thiazoles 2634-33-5
2634-33-5,MFCD00044001
Catalog No.:AA0032HI
2634-33-5 | 1,2-Benzisothiazol-3(2H)-one
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5g
98%
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$28.00
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25g
99%(GC)
in stock  
$39.00
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100g
99%(GC)
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$90.00
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500g
99%(GC)
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  • Technical Information
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  • Technical Information
  • Properties
  • Literature
Technical Information
Catalog Number:
AA0032HI
Chemical Name:
1,2-Benzisothiazol-3(2H)-one
CAS Number:
2634-33-5
Molecular Formula:
C7H5NOS
Molecular Weight:
151.1857
MDL Number:
MFCD00044001
IUPAC Name:
1,2-benzothiazol-3-one
InChI:
InChI=1S/C7H5NOS/c9-7-5-3-1-2-4-6(5)10-8-7/h1-4H,(H,8,9)
InChI Key:
DMSMPAJRVJJAGA-UHFFFAOYSA-N
SMILES:
Oc1nsc2c1cccc2
EC Number:
220-120-9
UNII:
HRA0F1A4R3
RTECS Number:
DE4620000
Properties
Computed Properties
 
Complexity:
160  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
151.009g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
151.183g/mol
Monoisotopic Mass:
151.009g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
54.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3  

Synonyms
 
1,2-benzisothiazolin-3-one 
1,2-benzisothiazoline-3-one 
Benzo[d]isothiazol-3(2H)-one 
SCHEMBL26078 
cid_17520 
KSC201Q7J 
MLS000771034 
REGID_for_CID_17520 
CHEMBL297304 
SCHEMBL5586024 
Jsp005181 
DTXSID5032523 
BDBM46658 
Proxel 
CTK1A1874 
HSDB 8271 
1,2-BIT 
HMS1755P21 
HMS2706H20 
KS-00000E5U 
ZINC2581983 
Tox21_300489 
ANW-43433 
MFCD00044001 
1,2-Benzisothiazoline-3-one 
MFCD00127753 
AKOS001062434 
AKOS030227972 
AC-2653 
CS-W018117 
FS-3163 
MCULE-3257757873 
NE11261 
1,2-BENZISOTHAZOL-3(2H)-ONE 
1,2-Benzisothiazol-3(2H)-one, 97% 
Benzo[d]isothiazol-3-one 
NCGC00164206-01 
NCGC00248077-01 
NCGC00254467-01 
AJ-43052 
AN-13744 
BC210059 
BR-46705 
LS-33607 
SC-15324 
SMR000344133 
Proxel PL 
US9011882, Table 1, Compound 20 
CAS-2634-33-5 
AB0008332 
AB1001358 
DB-027306 
TL8002104 
AM20060449 
B2430 
FT-0606282 
EN300-17679 
Benzo[d]isothiazol-3-ol 
34B335 
B66088 
M-4954 
634B335 
A818398 
AE-562/40151878 
1,2-Benzisothiazol-3(2H)-one, analytical standard 
I01-0074 
W-107178 
Z56983154 
2,3-dihydro-1,2-benzothiazol-3-one 
F0288-0100 
InChI=1/C7H5NOS/c9-7-5-3-1-2-4-6(5)10-8-7/h1-4H,(H,8,9 
Proxan 
benzisothiazolinone 
null 
Not Available 
12-Benzisothiazolone 
1,2-Benzisotiazolona 
12-Benzisothiazol-3-one 
1,2-bencisotiazol-3-ona 
Nipacide BIT 
1,2-Benzoisotiazol-3-ona 
1,2-benzisotiazolin-3-ona 
3-hidroxi-1,2benzisotiazol 
1 2-Benzoisothiazol-3-one 
3-Hydroxy-1 2-benzisothiazole 
12 BENCISOTIAZOL-3-ONA 
C7-H5-N-O-S 
2 3-Dihydrobenzisothiazol-3-one 
1,2-Bencisotiazol-3 (2H)-ona 
1,2-Benzisothiazolin-3-one(BIT) 
Proxel AB 
CID17520 
1, 2- benzisothiazol- 3(2H)- one 
CS-O-31458 
12-Benzisothiazolin-3-one (6CI7CI8CI) 
B3767 
C015699 
BIT 
1,2-Benzisothiazol-3(2H)-one, 98% - 100G 100g 
Aq 
GXL 
Proxel XL 2 
benzisothiazolinone 
1,2-BENZISOTHIAZOL-3-ONE 
benzoisothiazol-3-one 
1,2-benzoisothiazolin-3-one 
1,2-Benzisothiazolone 
Benzisothiazolin-3-one 
Caswell No. 079A 
Caswell No. 513A 
C7H5NOS 
UNII-HRA0F1A4R3 
Canguard BIT 
benzisothiazolone 
Proxel BD 
CCRIS 6369 
3-Hydroxy-1,2-benzisothiazole 
IPX 
CHEBI:167099 
Topcide 600 
Bioban BIT 20DPG 
EINECS 220-120-9 
Canguard BIT 20DPG 
EPA Pesticide Chemical Code 098901 
Proxel 
HRA0F1A4R3 
1,2-Benzoisothiazoline-3-one 
40991-37-5 
DMSMPAJRVJJAGA-UHFFFAOYSA-N 
2,3-dihydro-3-oxo-1,2-benzisothiazole 
MLS-0254244.0001 
Benzocil 
Acticide BIT 
Denicide BIT 
Proxel CF 
2634-33-5 
Proxel TN 
Proxel XL 
Proxel BDN 
Proxel GXL 
Proxel Ultra 5 
San-aibac AP 
Proxel LV-S 
Proxel Press Paste 
Apizas AP-DS 
Acticide BW 20 
1,2-Benzisothiazol-3(2H)-one 
Bestcide 200K 
Nipacide BIT 20 
Parmetol B 70 
Parmetol D 11 
Proxel GXL(S) 
Proxel HL 2 
Nuosept 485 
Nuosept 491 
Nuosept 495 
XBINX 
1,2-Benzisothiazolin-3-one 
Denicide BIT 20N 
Koralone B 119 
Nipacide BIT 10W 
Preventol BIT 20D 
Proxel BD 20 
Proxel Press Paste D 
Troysan 1050 
benzisothiazoline-3-one 
1,2-benzisothiazolinone 
SD 202 (bactericide) 
1,2-benzothiazol-3-one 
Canguard Ultra BIT 20LE 
1,2-Benzoisothiazol-3-one 
BIT 10W 
BIT 20 
2-Thiobenzimide 
2,3-Dihydrobenzisothiazol-3-one 
1,2-benzisothiazole-3(2h)-one 
SD 202 
1,2-Benzothiazolinone 
PubChem15685 
benzisothiazolone 
Benzisothiazolone (BIT) 
AC1Q6DWD 
ACMC-209u7v 
Epitope ID:115004 
Benzisothiazol-3(2H)-one 
AC1L2A5K 
AC1Q6H1E 
DSSTox_CID_12523 
DSSTox_RID_78967 
DSSTox_GSID_32523 
Literature

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Journal: The Journal of organic chemistry 20120420

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Journal: Chemosphere 20111101

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Journal: Bioorganic & medicinal chemistry 20111001

Title: Kinetic migration of isothiazolinone biocides from paper packaging to Tenax and Porapak.

Journal: Food additives & contaminants. Part A, Chemistry, analysis, control, exposure & risk assessment 20110901

Title: Ethyl 3-oxo-2,3-dihydro-1,2-benzothia-zole-2-carboxyl-ate.

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Title: Isopropyl 3-oxo-2,3-dihydro-1,2-benzothia-zole-2-carboxyl-ate.

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Title: Propyl 3-oxo-2,3-dihydro-1,2-benzothia-zole-2-carboxyl-ate.

Journal: Acta crystallographica. Section E, Structure reports online 20110901

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Journal: Acta crystallographica. Section E, Structure reports online 20110401

Title: Design and synthesis of an orally active metabotropic glutamate receptor subtype-2 (mGluR2) positive allosteric modulator (PAM) that decreases cocaine self-administration in rats.

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Journal: Cutaneous and ocular toxicology 20100901

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Journal: Environmental health : a global access science source 20100101

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Journal: Journal of occupational medicine and toxicology (London, England) 20100101

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Journal: European journal of medicinal chemistry 20090401

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