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1-[4-(thiomorpholin-4-yl)phenyl]methanamine

1-[4-(thiomorpholin-4-yl)phenyl]methanamine

CAS: 581812-68-2

Formula: C11H16N2S

SMILES: NCC1=CC=C(C=C1)N1CCSCC1

IUPAC: 1-[4-(thiomorpholin-4-yl)phenyl]methanamine

InChI: InChI=1S/C11H16N2S/c12-9-10-1-3-11(4-2-10)13-5-7-14-8-6-13/h1-4H,5-9,12H2

Composition: C (63.42%), H (7.74%), N (13.45%), S (15.39%)

Molar Mass: 208.32

Atom Count: 30

Heavy Atom Count: 14

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 208.103419697
Formal Charge 0
FSP3 0.45
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 1
InChIKey QTWKZMAZAXHXLC-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 64.32
Topological Polar Surface Area 29.26
Polarizability 24.55
Ring Count 2
Rotatable Bond Count 2

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90% <2 Days 581812-68-2 $51.35-$1,474.88$51.35$63.37$86.31$357.25$509.11$1,474.88
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