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1013398-58-7,MFCD12761536
Catalog No.:AA000467
1013398-58-7 | 5-Chloroindoline HCl
Pack Size
Purity
Availability
Price(USD)
Quantity
  
5g
96%
1 week  
$204.00   $143.00
- +
10g
96%
1 week  
$342.00   $239.00
- +
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Technical Information
Catalog Number:
AA000467
Chemical Name:
5-Chloroindoline HCl
CAS Number:
1013398-58-7
Molecular Formula:
C8H9Cl2N
Molecular Weight:
190.0698
MDL Number:
MFCD12761536
IUPAC Name:
5-chloro-2,3-dihydro-1H-indole;hydrochloride
InChI:
InChI=1S/C8H8ClN.ClH/c9-7-1-2-8-6(5-7)3-4-10-8;/h1-2,5,10H,3-4H2;1H
InChI Key:
PUGXFVNHRAMBQK-UHFFFAOYSA-N
SMILES:
Clc1ccc2c(c1)CCN2.Cl
Properties
Computed Properties
 
Complexity:
126  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
189.011g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
190.067g/mol
Monoisotopic Mass:
189.011g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
12A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0

Synonyms
 
5-Chloroindoline hydrochloride 
1013398-58-7 
ST2406223 
TC-134902 
X8558 
EN300-209354 
S-1587 
1H-Indole, 5-chloro-2,3-dihydro-, hydrochloride (1:1) 
5-Chloro-2,3-dihydro-1H-indole--hydrogen chloride (1/1) 
C8H9Cl2N 
5-Chloroindolinehydrochloride 
5-Chloro-2,3-dihydro-1H-indole hydrochloride 
5-Chloroindoline HCl 
CTK3J9698 
DTXSID40721000 
ANW-46157 
AKOS015919642 
BR-74274 
AX8219732 
Literature
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