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ethyl 2-{2-bromoimidazo[2,1-b][1,3,4]thiadiazol-6-yl}acetate

ethyl 2-{2-bromoimidazo[2,1-b][1,3,4]thiadiazol-6-yl}acetate

CAS: 1251008-63-5

Formula: C8H8BrN3O2S

SMILES: CCOC(=O)CC1=CN2N=C(Br)SC2=N1

IUPAC: ethyl 2-{2-bromoimidazo[2,1-b][1,3,4]thiadiazol-6-yl}acetate

InChI: InChI=1S/C8H8BrN3O2S/c1-2-14-6(13)3-5-4-12-8(10-5)15-7(9)11-12/h4H,2-3H2,1H3

Composition: C (33.12%), H (2.78%), Br (27.54%), N (14.48%), O (11.03%), S (11.05%)

Molar Mass: 290.14

Atom Count: 23

Heavy Atom Count: 15

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 288.952061
Formal Charge 0
FSP3 0.37
Hetero Ring Count 2
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 0
InChIKey ITGZTUDDMDQTRL-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 79.69
Topological Polar Surface Area 56.49
Polarizability 22.49
Ring Count 2
Rotatable Bond Count 4

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Purity LeadTime CAS UnitPrice
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Purity LeadTime CAS PacketSize UnitPrice
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