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19131-99-8 | (S)-N-Methyl-1-phenylethanamine
CAS No: 19131-99-8 Catalog No: AG003CEF MDL No:MFCD00067113
Product Description
Catalog Number:
AG003CEF
Chemical Name:
(S)-N-Methyl-1-phenylethanamine
CAS Number:
19131-99-8
Molecular Formula:
C9H13N
Molecular Weight:
135.2062
MDL Number:
MFCD00067113
IUPAC Name:
(1S)-N-methyl-1-phenylethanamine
InChI:
InChI=1S/C9H13N/c1-8(10-2)9-6-4-3-5-7-9/h3-8,10H,1-2H3/t8-/m0/s1
InChI Key:
RCSSHZGQHHEHPZ-QMMMGPOBSA-N
SMILES:
CN[C@H](c1ccccc1)C
UNII:
4MU17YEN7Y
Properties
Complexity:
84.7
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
135.105g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
135.21g/mol
Monoisotopic Mass:
135.105g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
12A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7
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