Home Bromides 40032-73-3
40032-73-3,MFCD00043883
Catalog No.:AA003IXG
40032-73-3 | 3-Bromo-2-chlorothiophene
Pack Size
Purity
Availability
Price(USD)
Quantity
  
1g
98%
in stock  
$15.00   $10.00
- +
5g
98%
in stock  
$35.00   $24.00
- +
25g
98%
in stock  
$115.00   $80.00
- +
100g
98%
in stock  
$445.00   $312.00
- +
  • Technical Information
  • Properties
  • Literature
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  • Q & A
  • Technical Information
  • Properties
  • Literature
Technical Information
Catalog Number:
AA003IXG
Chemical Name:
3-Bromo-2-chlorothiophene
CAS Number:
40032-73-3
Molecular Formula:
C4H2BrClS
Molecular Weight:
197.4807
MDL Number:
MFCD00043883
IUPAC Name:
3-bromo-2-chlorothiophene
InChI:
InChI=1S/C4H2BrClS/c5-3-1-2-7-4(3)6/h1-2H
InChI Key:
KSHOQKKCPJELBV-UHFFFAOYSA-N
SMILES:
Brc1ccsc1Cl
Properties
Computed Properties
 
Complexity:
68.7  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
195.875g/mol
Formal Charge:
0
Heavy Atom Count:
7  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
197.474g/mol
Monoisotopic Mass:
195.875g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
28.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5  

Synonyms
 
3-Bromo-2-chlorothiophene 
40032-73-3 
AC1MC56B 
KSC491I4T 
BIDD:GT0537 
SCHEMBL788030 
Jsp006929 
CTK3J1449 
KS-00000NXD 
DTXSID60369160 
KSHOQKKCPJELBV-UHFFFAOYSA-N 
3-Bromo-2-chlorothiophene, 98% 
2-Chloro-3-Bromo thiophene 
ZINC1023254 
ANW-29255 
GEO-00416 
SBB092197 
AKOS005258218 
AC-4917 
AS06591 
CM10917 
DS-2659 
MCULE-5904573808 
2-Chloro-3-bromothiophene 
PS-3797 
RP04120 
RTR-015965 
TRA0025449 
VT20199 
AJ-24697 
AK-25922 
AN-11531 
BC002913 
CJ-04674 
3-bromo-2-chloro-thiophene 
SC-46462 
ZB015645 
AB0011773 
DB-006360 
TR-015965 
A6689 
FT-0601075 
ST50405450 
B-3034 
032B733 
Thiophene, 3-bromo-2-chloro- 
I09-0216 
W-200349 
InChI=1/C4H2BrClS/c5-3-1-2-7-4(3)6/h1-2 
C4H2BrClS 
3,5-Dimethylbromobenzene 
4-dithiane-2,5-diol 
5-bromo-1,3-dimethylbenzene 
1-Bromo-3,5-dimethylbenzene 
1,4-Dithiane-2,5-diol 
2,5-Dihydroxy-1,4-dithiane 
OTAVA-BB 1904106 
ATTERCOP-CHM AT106575 
ZINC01023254 
ACN-036052 
CID2724559 
3-Bromo-2-chlorothiophene, 98% - 1G 1g 
B2013 
MFCD00043883 
PubChem5259 
ACMC-1APW4 
Literature

Title: Prediction of genotoxicity of chemical compounds by statistical learning methods.

Journal: Chemical research in toxicology 20050601

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