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2-(3-fluorophenyl)-1,3-thiazole-4-carboxylic acid

2-(3-fluorophenyl)-1,3-thiazole-4-carboxylic acid

CAS: 886369-06-8

Formula: C10H6FNO2S

SMILES: OC(=O)C1=CSC(=N1)C1=CC(F)=CC=C1

IUPAC: 2-(3-fluorophenyl)-1,3-thiazole-4-carboxylic acid

InChI: InChI=1S/C10H6FNO2S/c11-7-3-1-2-6(4-7)9-12-8(5-15-9)10(13)14/h1-5H,(H,13,14)

Composition: C (53.81%), H (2.71%), F (8.51%), N (6.27%), O (14.33%), S (14.36%)

Molar Mass: 223.22

Atom Count: 21

Heavy Atom Count: 15

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 223.010327774
Formal Charge 0
FSP3 0
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 1
InChIKey NDPPYHUQIRQQLD-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 63.47
Topological Polar Surface Area 50.19
Polarizability 20.48
Ring Count 2
Rotatable Bond Count 2

Suppliers

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Life Chemicals USA, Inc.
Purity LeadTime CAS PacketSize UnitPrice
95% <7 Days 886369-06-8 $36.63-$272.25$36.63$48.51$58.41$116.82$175.23$272.25
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Key Organics Ltd
Purity LeadTime CAS PacketSize UnitPrice
95% <2 Days 886369-06-8 $51.35-$180.26$51.35$63.37$86.31$113.62$180.26
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Struchem co.,ltd
Purity LeadTime CAS PacketSize UnitPrice
95% <5 Days 886369-06-8 $1,700.00-$2,860.00$1,700.00$2,860.00
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