Guidechem | China Chemical Manufacturers,suppliers,B2B Marketplace
Encyclop..
  • Products
  • Encyclopedia
  • Buy offers
  • Suppliers
Home> Encyclopedia >   /  Pharmaceutical Intermediates  /  Organic Intermediate  /  Syntheses Material Intermediates  /  Organic Intermediates  /  Agrochemical Intermediates
3-Pyridinecarbonitrile, 2,2'-dithiobis[4,6-diphenyl- (9CI) structure
3-Pyridinecarbonitrile, 2,2'-dithiobis[4,6-diphenyl- (9CI) structure

3-Pyridinecarbonitrile, 2,2'-dithiobis[4,6-diphenyl- (9CI)

Iupac Name:cyclopropylboronic acid
CAS No.:411235-57-9
Molecular Weight:85.897
1. Names and Identifiers
1.1 Name
3-Pyridinecarbonitrile, 2,2'-dithiobis[4,6-diphenyl- (9CI)
1.2 CAS No.
411235-57-9
1.3 CID
2760897
1.4 Molecular Formula
C18H22N2 (isomer)
1.5 Inchi
InChI=1S/C3H7BO2/c5-4(6)3-1-2-3/h3,5-6H,1-2H2
1.6 InChkey
WLVKDFJTYKELLQ-UHFFFAOYSA-N
1.7 Canonical Smiles
B(C1CC1)(O)O
1.8 Isomers Smiles
B(C1CC1)(O)O
2. Properties
3.1 Melting point
90-95℃
3.1 Refractive index
1.442
3.1 Precise Quality
86.05390
3.1 PSA
40.46000
3.1 logP
-0.37680
3. Safety and Handling
4.1 Symbol
GHS05;GHS07;GHS08;
4.1 Signal Word
DANGER
4.1 Risk Statements
R22
4.1 Safety Statements
26-36
4.1 Hazard Declaration
H302; H318; H360FD
4.1 WGK Germany
3
4. MSDS

2.Hazard identification

2.1 Classification of the substance or mixture

Not classified.

2.2 GHS label elements, including precautionary statements

Pictogram(s)
Signal word

Warning

Hazard statement(s)

H315 Causes skin irritation

H319 Causes serious eye irritation

H335 May cause respiratory irritation

Precautionary statement(s)
Prevention

none

Response

none

Storage

none

Disposal

none

2.3 Other hazards which do not result in classification

none

5. Computational chemical data
  • Molecular Weight:85.897g/mol
  • Molecular Formula:C18H22N2
  • Compound Is Canonicalized:True
  • XLogP3-AA:
  • Exact Mass:86.0539096
  • Monoisotopic Mass:86.0539096
  • Complexity:50.8
  • Rotatable Bond Count:1
  • Hydrogen Bond Donor Count:2
  • Hydrogen Bond Acceptor Count:2
  • Topological Polar Surface Area:40.5
  • Heavy Atom Count:6
  • Defined Atom Stereocenter Count:0
  • Undefined Atom Stereocenter Count:0
  • Defined Bond Stereocenter Count:0
  • Undefined Bond Stereocenter Count:0
  • Isotope Atom Count:0
  • Covalently-Bonded Unit Count:1
6. Recommended Suppliers
Global297SuppliersView all >>
  • Products:Anastrozole,Letrozole,Epalrestat,Rhodanine-3-acetic acid,Methylboronic acid
  • Tel:86-21-00000000
  • Email:nataling@vip.163.com
Cyclopropylboronic acid
  • Purity:99%Packing: 200kg/bag FOB
  • Price:  
  • Time: 2022/05/20
Inquire
  • Products:Cosmetic Raw Materials,solvents,etc.
  • Tel:86-311-66562153
  • Email:breeduan@crovellbio.com
China factory supply Cyclopropylboronic acid CAS 411235-57-9
  • Purity:99%Packing: 200kg/bag FOB
  • Price: 10 USD/kilogram
  • Time: 2022/05/05
Inquire
  • Products:Division I, the main production Lead acetate phenylacetamide Cyromazine quality is very good!
  • Tel:86-311-66561638
  • Email:xing@yan-xi.com
Cyclopropylboronic acid
  • Purity:99%Packing: 200kg/bag FOB
  • Price: 1 USD/kilogram
  • Time: 2022/05/20
Inquire
  • Products:Chemical raw materials, pharmaceutical intermediates 4f-adb;5cl-adb-a;eutylone;U48800;BK-EBDP;SGT78
  • Tel:+86-0311-13373049538
  • Email:admin@sunton88.com
Cyclopropylboronic acid
  • Purity:99%Packing: 200kg/bag FOB
  • Price: 125 USD/kilogram
  • Time: 2022/04/25
Inquire
  • Products:Manufacture & Supply Biopharm Chemical, Specialty Chemical, PetroChemical.
  • Tel:86-592-8883942
  • Email:sale@amitychem.com
Factory Supply Cycloropylboronic Acid
  • Purity:99%Packing: 200kg/bag FOB
  • Price: 0.1 USD/kilogram
  • Time: 2022/02/09
Inquire