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methyl[(7S)-4H,5H,7H-thieno[2,3-c]pyran-7-ylmethyl]amine hydrochloride

methyl[(7S)-4H,5H,7H-thieno[2,3-c]pyran-7-ylmethyl]amine hydrochloride

CAS: 1310422-41-3

Formula: C9H14ClNOS

SMILES: Cl.CNC[C@@H]1OCCC2=C1SC=C2

IUPAC: methyl({[(7S)-4H,5H,7H-thieno[2,3-c]pyran-7-yl]methyl})amine hydrochloride

InChI: InChI=1S/C9H13NOS.ClH/c1-10-6-8-9-7(2-4-11-8)3-5-12-9;/h3,5,8,10H,2,4,6H2,1H3;1H/t8-;/m0./s1

Composition: C (49.20%), H (6.42%), Cl (16.13%), N (6.37%), O (7.28%), S (14.59%)

Molar Mass: 219.73

Atom Count: 27

Heavy Atom Count: 13

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 1
Exact Mass 219.0484629
Formal Charge 0
FSP3 0.56
Hetero Ring Count 2
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 1
InChIKey JRDQGVVFSHRVTL-QRPNPIFTSA-N
Lipinski's Rule of Five 1
Molar Refractivity 50.22
Topological Polar Surface Area 21.26
Polarizability 19.59
Ring Count 2
Rotatable Bond Count 2

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Purity LeadTime CAS PacketSize UnitPrice
99.78% <7 Days 1310422-41-3 $177.65-$1,168.75$177.65$289.85$748.00$1,168.75
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98% <4 Days 1310422-41-3 $210.97-$1,278.08$210.97$352.39$632.16$886.70$1,278.08
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