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Home Other Building Blocks Benzenemethanamine, 2-methoxy-α-(trifluoromethyl)-, hydrochloride (1:1)

Benzenemethanamine, 2-methoxy-α-(trifluoromethyl)-, hydrochloride (1:1)

CAS No.:
1228880-25-8
Catalog Number:
AG000JP1
Molecular Formula:
C9H11ClF3NO
Molecular Weight:
241.6379
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Product Description
Catalog Number:
AG000JP1
Chemical Name:
Benzenemethanamine, 2-methoxy-α-(trifluoromethyl)-, hydrochloride (1:1)
CAS Number:
1228880-25-8
Molecular Formula:
C9H11ClF3NO
Molecular Weight:
241.6379
MDL Number:
MFCD11841105
IUPAC Name:
2,2,2-trifluoro-1-(2-methoxyphenyl)ethanamine;hydrochloride
InChI:
InChI=1S/C9H10F3NO.ClH/c1-14-7-5-3-2-4-6(7)8(13)9(10,11)12;/h2-5,8H,13H2,1H3;1H
InChI Key:
YZQDZBQXSQCSMM-UHFFFAOYSA-N
SMILES:
COc1ccccc1C(C(F)(F)F)N.Cl
Properties
Complexity:
183  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
241.048g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
241.638g/mol
Monoisotopic Mass:
241.048g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
35.2A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
Properties