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23294-41-9 | Benzenemethanamine, α-methyl-N-[(1R)-1-phenylethyl]-, (αR)-
CAS No: 23294-41-9 Catalog No: AG002MT9 MDL No:MFCD00243088
Product Description
Catalog Number:
AG002MT9
Chemical Name:
Benzenemethanamine, α-methyl-N-[(1R)-1-phenylethyl]-, (αR)-
CAS Number:
23294-41-9
Molecular Formula:
C16H19N
Molecular Weight:
225.3288
MDL Number:
MFCD00243088
IUPAC Name:
(1R)-1-phenyl-N-[(1R)-1-phenylethyl]ethanamine
InChI:
InChI=1S/C16H19N/c1-13(15-9-5-3-6-10-15)17-14(2)16-11-7-4-8-12-16/h3-14,17H,1-2H3/t13-,14-/m1/s1
InChI Key:
NXLACVVNHYIYJN-ZIAGYGMSSA-N
SMILES:
C[C@H](c1ccccc1)N[C@@H](c1ccccc1)C
UNII:
72S7Q417U4
Properties
Complexity:
180
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
2
Defined Bond Stereocenter Count:
0
Exact Mass:
225.152g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
225.335g/mol
Monoisotopic Mass:
225.152g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
12A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6
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