Home Amines 1098070-11-1
1098070-11-1,MFCD12147965
Catalog No.:AA00963M
1098070-11-1 | 1-(2-CHLORO-4-FLUOROPHENYL)ETHAN-1-AMINE
Pack Size
Purity
Availability
Price(USD)
Quantity
  
100mg
95.0%
3 weeks  
$248.00
- +
250mg
95.0%
3 weeks  
$342.00
- +
500mg
95.0%
3 weeks  
$628.00
- +
1g
95.0%
3 weeks  
$826.00
- +
  • Technical Information
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Technical Information
Catalog Number:
AA00963M
Chemical Name:
1-(2-CHLORO-4-FLUOROPHENYL)ETHAN-1-AMINE
CAS Number:
1098070-11-1
Molecular Formula:
C8H9ClFN
Molecular Weight:
173.6152
MDL Number:
MFCD12147965
IUPAC Name:
1-(2-chloro-4-fluorophenyl)ethanamine
InChI:
InChI=1S/C8H9ClFN/c1-5(11)7-3-2-6(10)4-8(7)9/h2-5H,11H2,1H3
InChI Key:
JTMGFESJCXOUCW-UHFFFAOYSA-N
SMILES:
Fc1ccc(c(c1)Cl)C(N)C
Properties
Computed Properties
 
Complexity:
131  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
173.041g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
173.615g/mol
Monoisotopic Mass:
173.041g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
26A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9  

Synonyms
 
1-(2-chloro-4-fluorophenyl)ethan-1-amine 
1098070-11-1 
1212154-58-9 
(1S)-1-(2-chloro-4-fluorophenyl)ethan-1-amine 
SCHEMBL6816256 
AKOS009235152 
NE33921 
EN300-80831 
(1R)-1-(2-chloro-4-fluorophenyl)ethan-1-amine 
1212201-70-1 
Literature
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