Boronic acid,B-[3-[[(4,5-dihydro-2-thiazolyl)amino]carbonyl]phenyl]- supplier

Name
3-((4,5-DIHYDROTHIAZOL-2-YL)CARBAMOYL)PHENYLBORONIC ACID
EINECS
CAS No. 871333-06-1
Density 1.41 g/cm³
Solubility
Melting Point 204-240 °C
Formula C₁₀H₁₁BN₂O₃S
Boiling Point
Molecular Weight 250.086
Flash Point
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols Xi
Synonyms Boronicacid, [3-[[(4,5-dihydro-2-thiazolyl)amino]carbonyl]phenyl]- (9CI);
PSA 107.22000
LogP -0.97450

Boronic acid,B-[3-[[(4,5-dihydro-2-thiazolyl)amino]carbonyl]phenyl]- Specification

The Boronic acid,B-[3-[[(4,5-dihydro-2-thiazolyl)amino]carbonyl]phenyl]- is an organic compound with the formula C₁₀H₁₁BN₂O₃S. The systematic name of this chemical is [3-(4,5-dihydrothiazol-2-ylcarbamoyl)phenyl]boronic acid. With the CAS registry number 871333-06-1, it is also named as 3-[(4,5-Dihydrothiazol-2-yl)carbamoyl]benzeneboronic acid. The product's categories are Blocks; BoronicAcids.

Physical properties about Boronic acid,B-[3-[[(4,5-dihydro-2-thiazolyl)amino]carbonyl]phenyl]- are: (1)ACD/LogP: 0.05; (2)ACD/LogD (pH 5.5): 0.04; (3)#H bond acceptors: 5; (4)#H bond donors: 3; (5)#Freely Rotating Bonds: 4; (6)Polar Surface Area: 107.22 Å²; (7)Index of Refraction: 1.651; (8)Molar Refractivity: 64.84 cm³; (9)Molar Volume: 177.3 cm³; (10)Polarizability: 25.7×10^-24cm³; (11)Surface Tension: 57.9 dyne/cm; (12)Density: 1.41 g/cm³.

You can still convert the following datas into molecular structure:
(1)SMILES: B(c1cccc(c1)C(=O)NC2=NCCS2)(O)O
(2)InChI: InChI=1/C10H11BN2O3S/c14-9(13-10-12-4-5-17-10)7-2-1-3-8(6-7)11(15)16/h1-3,6,15-16H,4-5H2,(H,12,13,14)
(3)InChIKey: JKXDTFJXMNWUFU-UHFFFAOYAS
(4)Std. InChI: InChI=1S/C10H11BN2O3S/c14-9(13-10-12-4-5-17-10)7-2-1-3-8(6-7)11(15)16/h1-3,6,15-16H,4-5H2,(H,12,13,14)
(5)Std. InChIKey: JKXDTFJXMNWUFU-UHFFFAOYSA-N

Product Name

3-((4,5-DIHYDROTHIAZOL-2-YL)CARBAMOYL)PHENYLBORONIC ACID

Boronic acid,B-[3-[[(4,5-dihydro-2-thiazolyl)amino]carbonyl]phenyl]- Specification

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