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1397192-35-6 | Benzenemethanamine, 2-fluoro-N-methyl-6-phenoxy-, hydrochloride (1:1)
CAS No: 1397192-35-6 Catalog No: AG001BKH MDL No:MFCD12546206
Product Description
Catalog Number:
AG001BKH
Chemical Name:
Benzenemethanamine, 2-fluoro-N-methyl-6-phenoxy-, hydrochloride (1:1)
CAS Number:
1397192-35-6
Molecular Formula:
C14H15ClFNO
Molecular Weight:
267.7264
MDL Number:
MFCD12546206
IUPAC Name:
1-(2-fluoro-6-phenoxyphenyl)-N-methylmethanamine;hydrochloride
InChI:
InChI=1S/C14H14FNO.ClH/c1-16-10-12-13(15)8-5-9-14(12)17-11-6-3-2-4-7-11;/h2-9,16H,10H2,1H3;1H
InChI Key:
HHOQSRNTBSKBJE-UHFFFAOYSA-N
SMILES:
CNCc1c(cccc1F)Oc1ccccc1.Cl
Properties
Complexity:
218
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
267.083g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
267.728g/mol
Monoisotopic Mass:
267.083g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
21.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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