Home Other Building Blocks (1S)-1-(3-FLUORO-4-METHYLPHENYL)ETHYLAMINE

(1S)-1-(3-FLUORO-4-METHYLPHENYL)ETHYLAMINE

CAS No.:
1241682-49-4
Catalog Number:
AG009ZAE
Molecular Formula:
C9H13ClFN
Molecular Weight:
189.6576
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Product Description
Catalog Number:
AG009ZAE
Chemical Name:
(1S)-1-(3-FLUORO-4-METHYLPHENYL)ETHYLAMINE
CAS Number:
1241682-49-4
Molecular Formula:
C9H13ClFN
Molecular Weight:
189.6576
MDL Number:
MFCD06762068
IUPAC Name:
(1S)-1-(3-fluoro-4-methylphenyl)ethanamine
InChI:
InChI=1S/C9H12FN/c1-6-3-4-8(7(2)11)5-9(6)10/h3-5,7H,11H2,1-2H3/t7-/m0/s1
InChI Key:
LTXLBDDARARPQF-ZETCQYMHSA-N
SMILES:
C[C@@H](c1ccc(c(c1)F)C)N.Cl
Properties
Complexity:
127  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
1  
Defined Bond Stereocenter Count:
0
Exact Mass:
153.095g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
153.2g/mol
Monoisotopic Mass:
153.095g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
26A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6  
Properties