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methyl 2-(2-bromophenyl)-1,3-thiazole-4-carboxylate

methyl 2-(2-bromophenyl)-1,3-thiazole-4-carboxylate

CAS: 1360438-63-6

Formula: C11H8BrNO2S

SMILES: COC(=O)C1=CSC(=N1)C1=C(Br)C=CC=C1

IUPAC: methyl 2-(2-bromophenyl)-1,3-thiazole-4-carboxylate

InChI: InChI=1S/C11H8BrNO2S/c1-15-11(14)9-6-16-10(13-9)7-4-2-3-5-8(7)12/h2-6H,1H3

Composition: C (44.31%), H (2.70%), Br (26.80%), N (4.70%), O (10.73%), S (10.75%)

Molar Mass: 298.15

Atom Count: 24

Heavy Atom Count: 16

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 296.945913
Formal Charge 0
FSP3 0.09
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 0
InChIKey SXBWNZZCZSFDLU-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 75.64
Topological Polar Surface Area 39.19
Polarizability 25.68
Ring Count 2
Rotatable Bond Count 3

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95% <5 Days 1360438-63-6 $830.00-$1,846.00$830.00$1,386.00$1,846.00
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