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1,3-thiazol-4-ylboronic acid

1,3-thiazol-4-ylboronic acid

CAS: 1016642-07-1

Formula: C3H4BNO2S

SMILES: OB(O)C1=CSC=N1

IUPAC: (1,3-thiazol-4-yl)boronic acid

InChI: InChI=1S/C3H4BNO2S/c6-4(7)3-1-8-2-5-3/h1-2,6-7H

Composition: C (27.95%), H (3.13%), B (8.38%), N (10.86%), O (24.82%), S (24.86%)

Molar Mass: 128.94

Atom Count: 12

Heavy Atom Count: 8

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 129.00558
Formal Charge 0
FSP3 0
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 2
InChIKey WSTDOIHBEOVTHX-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 26.13
Topological Polar Surface Area 53.35
Polarizability 11.42
Ring Count 1
Rotatable Bond Count 1

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Key Organics Ltd
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95% <2 Days 1016642-07-1 $945.01$945.01$945.01
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AA BLOCKS INC
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Struchem co.,ltd
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95% <5 Days 1016642-07-1 $620.00-$739.00$620.00$739.00
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