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4187-56-8 | (S)-1-(4-Chlorophenyl)ethanamine
CAS No: 4187-56-8 Catalog No: AG003CIS MDL No:MFCD00671640
Product Description
Catalog Number:
AG003CIS
Chemical Name:
(S)-1-(4-Chlorophenyl)ethanamine
CAS Number:
4187-56-8
Molecular Formula:
C8H10ClN
Molecular Weight:
155.6247
MDL Number:
MFCD00671640
IUPAC Name:
(1S)-1-(4-chlorophenyl)ethanamine
InChI:
InChI=1S/C8H10ClN/c1-6(10)7-2-4-8(9)5-3-7/h2-6H,10H2,1H3/t6-/m0/s1
InChI Key:
PINPOEWMCLFRRB-LURJTMIESA-N
SMILES:
C[C@@H](c1ccc(cc1)Cl)N
Properties
Complexity:
97.4
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
155.05g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
155.625g/mol
Monoisotopic Mass:
155.05g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
26A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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