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5-methoxy-3,4-dihydro-2H-1-benzothiopyran-3-amine

5-methoxy-3,4-dihydro-2H-1-benzothiopyran-3-amine

CAS: 109140-19-4

Formula: C10H13NOS

SMILES: COC1=CC=CC2=C1CC(N)CS2

IUPAC: 5-methoxy-3,4-dihydro-2H-1-benzothiopyran-3-amine

InChI: InChI=1/C10H13NOS/c1-12-9-3-2-4-10-8(9)5-7(11)6-13-10/h2-4,7H,5-6,11H2,1H3

Composition: C (61.51%), H (6.71%), N (7.17%), O (8.19%), S (16.42%)

Molar Mass: 195.28

Atom Count: 26

Heavy Atom Count: 13

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 1
Exact Mass 195.071785217
Formal Charge 0
FSP3 0.4
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 1
InChIKey VORYRUKJTFFASM-UHFFFAOYNA-N
Lipinski's Rule of Five 1
Molar Refractivity 56.41
Topological Polar Surface Area 35.25
Polarizability 22.14
Ring Count 2
Rotatable Bond Count 1

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96% <2 Days 109140-19-4 $179.40-$4,597.70$179.40$243.80$373.75$631.35$1,147.70$4,597.70
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