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N-{4-[(hydroxyimino)methyl]-4-methyl-1,3-dithiolan-2-ylidene}propan-2-amine

N-{4-[(hydroxyimino)methyl]-4-methyl-1,3-dithiolan-2-ylidene}propan-2-amine

CAS: 298219-58-6

Formula: C8H14N2OS2

SMILES: CC(C)N=C1SCC(C)(S1)C=NO

IUPAC: N-{4-[(hydroxyimino)methyl]-4-methyl-1,3-dithiolan-2-ylidene}propan-2-amine

InChI: InChI=1/C8H14N2OS2/c1-6(2)10-7-12-5-8(3,13-7)4-9-11/h4,6,11H,5H2,1-3H3

Composition: C (44.01%), H (6.46%), N (12.83%), O (7.33%), S (29.37%)

Molar Mass: 218.33

Atom Count: 27

Heavy Atom Count: 13

Properties
Properties
Common Names N/A
Aromatic Ring Count 0
Asymmetric Atom Count 1
Exact Mass 218.054755427
Formal Charge 0
FSP3 0.75
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 1
InChIKey APMJQTKCTQKPFR-UHFFFAOYNA-N
Lipinski's Rule of Five 1
Molar Refractivity 59.57
Topological Polar Surface Area 44.95
Polarizability 23.07
Ring Count 1
Rotatable Bond Count 2

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Purity LeadTime CAS PacketSize UnitPrice
90% <2 Days 298219-58-6 $51.35-$86.31$51.35$63.37$86.31
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