2-Chloro-4-picoline

Details:

1. Introduction of 2-Chloro-4-picoline

2-Chloro-4-picoline (CAS NO.3678-62-4) is a colorless to slight yellow liquid and can be used as a intermediate. We can provide the ≥98%(HPLC) to you. Our production capacity is 5 metric ton per year. The FOB price is 0-10000 USD/kilogram. It is in stock and can be sent from the beijing port. Besides, you can pay us via the L/C or T/T.

Other detailed information:

Appearance :Colorless to slight yellow liquid
Assay: ≥98%(HPLC)
Formula:     C₆H₆ClN    
CAS NO.:  3678-62-4                                                                                                             
M.W.:        127.57
Feature:      Colorless to slight yellow liquid, bp 194-195℃，nD201. 529,d4201.456, fp 89℃.

2. Basic information of 2-Chloro-4-picoline

1) Properties:

(1)XLogP3: 1.9; (2)H-Bond Donor: 0; (3)H-Bond Acceptor: 1; (4)Rotatable Bond Count: 0; (5)Exact Mass: 127.018877; (6)MonoIsotopic Mass: 127.018877; (7)Topological Polar Surface Area: 12.9; (8)Heavy Atom Count: 8; (9)Formal Charge: 0; (10)Complexity: 74.9; (11)Isotope Atom Count: 0; (12)Defined Atom Stereocenter Count: 0; (13)Undefined Atom Stereocenter Count: 0; (14)Defined Bond Stereocenter Count: 0; (15)Undefined Bond Stereocenter Count: 0; (16)Covalently-Bonded Unit Count: 1; (17)Feature 3D Acceptor Count: 1; (18)Feature 3D Ring Count: 1; (19)Effective Rotor Count: 0; (20)Conformer Sampling RMSD: 0.4.

2) Physical Property

Physical Property	Value	Units	Temp (deg C)	Source
Melting Point	115	deg C		EXP
Boiling Point	192	deg C		EXP
log P (octanol-water)	2.000	(none)		EST
Atmospheric OH Rate Constant	8.15E-13	cm3/molecule-sec	25	EST

3) Descriptors of Structure

IUPAC Name: 2-chloro-4-methylpyridine
InChI: InChI=1S/C6H6ClN/c1-5-2-3-8-6(7)4-5/h2-4H,1H3
InChIKey: MZVSTDHRRYQFGI-UHFFFAOYSA-N
Canonical SMILES: CC1=CC(=NC=C1)Cl