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ethyl N-(4-acetyl-3-methyl-1,2-thiazol-5-yl)carbamate

ethyl N-(4-acetyl-3-methyl-1,2-thiazol-5-yl)carbamate

CAS: 120750-19-8

Formula: C9H12N2O3S

SMILES: CCOC(=O)NC1=C(C(C)=O)C(C)=NS1

IUPAC: ethyl N-(4-acetyl-3-methyl-1,2-thiazol-5-yl)carbamate

InChI: InChI=1S/C9H12N2O3S/c1-4-14-9(13)10-8-7(6(3)12)5(2)11-15-8/h4H2,1-3H3,(H,10,13)

Composition: C (47.36%), H (5.30%), N (12.27%), O (21.03%), S (14.05%)

Molar Mass: 228.27

Atom Count: 27

Heavy Atom Count: 15

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 228.056863428
Formal Charge 0
FSP3 0.44
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 4
Hydrogen Bond Donor Count 1
InChIKey JDCAMRDRXRPOOD-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 57.39
Topological Polar Surface Area 68.29
Polarizability 21.18
Ring Count 1
Rotatable Bond Count 4

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Purity LeadTime CAS PacketSize UnitPrice
95% <2 Days 120750-19-8 $134.76$134.76
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