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2,2-dimethylpropyl N-(4-methyl-1,2,3-thiadiazol-5-yl)carbamate

2,2-dimethylpropyl N-(4-methyl-1,2,3-thiadiazol-5-yl)carbamate

CAS: 338960-85-3

Formula: C9H15N3O2S

SMILES: CC1=C(NC(=O)OCC(C)(C)C)SN=N1

IUPAC: 2,2-dimethylpropyl N-(4-methyl-1,2,3-thiadiazol-5-yl)carbamate

InChI: InChI=1S/C9H15N3O2S/c1-6-7(15-12-11-6)10-8(13)14-5-9(2,3)4/h5H2,1-4H3,(H,10,13)

Composition: C (47.14%), H (6.59%), N (18.33%), O (13.95%), S (13.98%)

Molar Mass: 229.3

Atom Count: 30

Heavy Atom Count: 15

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 229.088497909
Formal Charge 0
FSP3 0.67
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 4
Hydrogen Bond Donor Count 1
InChIKey JFNRLYRLHGMVHS-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 58.74
Topological Polar Surface Area 64.11
Polarizability 22.06
Ring Count 1
Rotatable Bond Count 4

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Key Organics Ltd
Purity LeadTime CAS PacketSize UnitPrice
90% <2 Days 338960-85-3 $51.35-$86.31$51.35$63.37$86.31
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