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30339-30-1 | Benzeneethanamine, 4-methyl-α-phenyl-, (αS)-
CAS No: 30339-30-1 Catalog No: AG002ZS6 MDL No:MFCD00221505
Product Description
Catalog Number:
AG002ZS6
Chemical Name:
Benzeneethanamine, 4-methyl-α-phenyl-, (αS)-
CAS Number:
30339-30-1
Molecular Formula:
C15H17N
Molecular Weight:
211.3022
MDL Number:
MFCD00221505
IUPAC Name:
(1S)-2-(4-methylphenyl)-1-phenylethanamine
InChI:
InChI=1S/C15H17N/c1-12-7-9-13(10-8-12)11-15(16)14-5-3-2-4-6-14/h2-10,15H,11,16H2,1H3/t15-/m0/s1
InChI Key:
ZICDZTXDTPZBKH-HNNXBMFYSA-N
SMILES:
Cc1ccc(cc1)C[C@@H](c1ccccc1)N
Properties
Complexity:
188
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
211.136g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
211.308g/mol
Monoisotopic Mass:
211.136g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
26A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1
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