3-(N,N-Dimethylaminocarbonyl)phenylboronic acid supplier

Name
3-(DIMETHYLCARBAMOYL)PHENYLBORONIC ACID
EINECS
CAS No. 373384-14-6
Density 1.207 g/cm³
Solubility
Melting Point 122-128 °C
Formula C₉H₁₂BNO₃
Boiling Point 422.971 °C at 760 mmHg
Molecular Weight 193.01
Flash Point 209.605 °C
Transport Information
Appearance
Safety 26-36/37/39
Risk Codes 36/37/38
Molecular Structure
Hazard Symbols Xi
Synonyms Boronicacid, [3-[(dimethylamino)carbonyl]phenyl]- (9CI);N,N-Dimethyl-3-boronobenzamide;N,N-Dimethylbenzamide-3-boronic acid;[3-(N,N-Dimethylaminocarbonyl)phenyl]boronic acid;3-(Dimethylcarbamoyl)phenylboronic acid;
PSA 60.77000
LogP -0.93180

3-(N,N-Dimethylaminocarbonyl)phenylboronic acid Specification

This chemical is called Boronic acid, B-[3-[(dimethylamino)carbonyl]phenyl]-, and its systematic name is [3-(dimethylcarbamoyl)phenyl]boronic acid. With the molecular formula of C₉H₁₂BNO₃, its molecular weight is 193.01. The CAS registry number of this chemical is 373384-14-6. Additionally, its product categories are Blocks; Boronic Acids; Amide; Aryl.

Other characteristics of the Boronic acid, B-[3-[(dimethylamino)carbonyl]phenyl]- can be summarised as followings: (1)ACD/LogP: -0.19; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -0.2; (4)ACD/LogD (pH 7.4): -0.35; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 18.58; (8)ACD/KOC (pH 7.4): 12.93; (9)#H bond acceptors: 4; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 4; (12)Polar Surface Area: 38.77 Å²; (13)Index of Refraction: 1.553; (14)Molar Refractivity: 51.17 cm³; (15)Molar Volume: 159.8 cm³; (16)Polarizability: 20.28×10^-24cm³; (17)Surface Tension: 48.3 dyne/cm; (18)Density: 1.2 g/cm³; (19)Flash Point: 209.6 °C; (20)Enthalpy of Vaporization: 71.39 kJ/mol; (21)Boiling Point: 423 °C at 760 mmHg; (22)Vapour Pressure: 6.56E-08 mmHg at 25°C.

When you are using this chemical, please be cautious about it as the following: This chemical is irritating to eyes, respiratory system and skin. You should wear suitable protective clothing if you use it. In case of contacting with eyes, rinse immediately with plenty of water and seek medical advice.

You can still convert the following datas into molecular structure:
1.SMILES: O=C(c1cc(B(O)O)ccc1)N(C)C
2.InChI: InChI=1/C9H12BNO3/c1-11(2)9(12)7-4-3-5-8(6-7)10(13)14/h3-6,13-14H,1-2H3
3.InChIKey: DCXXIDMHTQDSLY-UHFFFAOYAB

Product Name

3-(DIMETHYLCARBAMOYL)PHENYLBORONIC ACID

3-(N,N-Dimethylaminocarbonyl)phenylboronic acid Specification

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