Home Amines 1306604-78-3
1306604-78-3,MFCD18838974
Catalog No.:AA01AI80
1306604-78-3 | 2-(2-chloro-4-fluorophenyl)propan-2-amine hydrochloride
Pack Size
Purity
Availability
Price(USD)
Quantity
  
100mg
95.0%
3 weeks  
$280.00
- +
250mg
95.0%
3 weeks  
$386.00
- +
  • Technical Information
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  • Technical Information
  • Properties
  • Literature
Technical Information
Catalog Number:
AA01AI80
Chemical Name:
2-(2-chloro-4-fluorophenyl)propan-2-amine hydrochloride
CAS Number:
1306604-78-3
Molecular Formula:
C9H12Cl2FN
Molecular Weight:
224.1027
MDL Number:
MFCD18838974
IUPAC Name:
2-(2-chloro-4-fluorophenyl)propan-2-amine;hydrochloride
InChI:
InChI=1S/C9H11ClFN.ClH/c1-9(2,12)7-4-3-6(11)5-8(7)10;/h3-5H,12H2,1-2H3;1H
InChI Key:
CQNBHJGHRQJJJX-UHFFFAOYSA-N
SMILES:
Fc1ccc(c(c1)Cl)C(N)(C)C.Cl
Properties
Computed Properties
 
Complexity:
161  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
223.033g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
224.1g/mol
Monoisotopic Mass:
223.033g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
26A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0

Synonyms
 
2-(2-chloro-4-fluorophenyl)propan-2-amine hydrochloride 
1306604-78-3 
MCULE-2396001066 
NE51063 
EN300-77247 
Z1267881731 
Literature
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