6-chloro-1-methyl-4-(phenylsulfanyl)-3,4-dihydroquinolin-2(1H)-one structure

3D Mol Similar

6-chloro-1-methyl-4-(phenylsulfanyl)-3,4-dihydroquinolin-2(1H)-one

Iupac Name：5-acetamido-2,4-dihydroxy-6-(1,2,3-trihydroxypropyl)oxane-2-carboxylic acid

CAS No.：131-48-6

Molecular Weight：309.27000

Request For Quotation

1. Names and Identifiers

1.1 Name: 6-chloro-1-methyl-4-(phenylsulfanyl)-3,4-dihydroquinolin-2(1H)-one
1.2 Synonyms: 6-chloro-1-methyl-4-(phenylsulfanyl)-3,4-dihydroquinolin-2-one 6-chloro-1-methyl-4-(phenylthio)-3,4-dihydro-2(1h)-quinolinone 6-chloro-1-methyl-4-phenylsulfanyl-3,4-dihydroquinolin-2-one AC1L6YWM AKOS030558286 CTK5C4441 HE210252 nsc 298365 nsc298365

1.3 CAS No.: 131-48-6

1.4 CID: 906

1.5 Molecular Formula: C₈H₁₄N₄S (isomer)

1.6 Inchi: InChI=1S/C11H19NO9/c1-4(14)12-7-5(15)2-11(20,10(18)19)21-9(7)8(17)6(16)3-13/h5-9,13,15-17,20H,2-3H2,1H3,(H,12,14)(H,18,19)

1.7 InChkey: SQVRNKJHWKZAKO-UHFFFAOYSA-N

1.8 Canonical Smiles: CC(=O)NC1C(CC(OC1C(C(CO)O)O)(C(=O)O)O)O

1.9 Isomers Smiles: CC(=O)NC1C(CC(OC1C(C(CO)O)O)(C(=O)O)O)O

2. Properties

3.1 Melting point: 184-186°C (dec.)(lit.)

3.1 Refractive index: -32 ° (C=1, H2O)

3.1 Vapour pressure: 5.5E-30mmHg at 25°C

3.1 Precise Quality: 309.10600

3.1 PSA: 176.78000

3.1 logP: -3.48090

3. Safety and Handling

4.1 Risk Statements: R36/37/38

4.1 Safety Statements: S22-S24/25

4.1 RIDADR: NONH for all modes of transport

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)	No symbol.
Signal word	No signal word.
Hazard statement(s)	none
Precautionary statement(s)
Prevention	none
Response	none
Storage	none
Disposal	none

2.3 Other hazards which do not result in classification

none

View all

5. Computational chemical data

Molecular Weight：309.27000g/mol
Molecular Formula：C_₈H_₁₄N_₄S
Compound Is Canonicalized：True
XLogP3-AA：_3.5
Exact Mass：309.10598118
Monoisotopic Mass：309.10598118
Complexity：403
Rotatable Bond Count：5
Hydrogen Bond Donor Count：7
Hydrogen Bond Acceptor Count：9
Topological Polar Surface Area：177
Heavy Atom Count：21
Defined Atom Stereocenter Count：0
Undefined Atom Stereocenter Count：6
Defined Bond Stereocenter Count：0
Undefined Bond Stereocenter Count：0
Isotope Atom Count：0
Covalently-Bonded Unit Count：1

6. Recommended Suppliers

Global264SuppliersView all >>

Hebei Yanxi Chemical Co.,Ltd Diamond member

3YRS

Products:Division I, the main production Lead acetate phenylacetamide Cyromazine quality is very good!
Tel:86-311-66561638
Email:xing@yan-xi.com

N- acetylneuraminic acid

Purity:99%Packing: 200kg/bag FOB
Price: 1 USD/kilogram
Time: 2022/05/24

Inquire

Jilin Tely Imp & Exp Co., Ltd Diamond member

3YRS

Products:Pharmaceutical raw materials,Chemical reagent, Food aditives,Plant ExtracPharmaceutical and pesticide intermediates.
Tel:86-431-81915458
Email:cathytan@jltely.com

-Acetylneuraminic acid

Purity:99%Packing: 200kg/bag FOB
Price: 1 USD/gram
Time: 2022/05/24

Inquire

Hebei Zebo Biotechnology Co., LTD Diamond member

1YR

Products:Organic intermediates, Organic solvents,Cosmetic raw materials ...
Tel:00-86-15176962104
Email:Alice@hbzebo.com

Factory supply N-Acetylneuraminic acid NO 131-48-6

Purity:99%Packing: 200kg/bag FOB
Price: 10 USD/kg
Time: 2022/05/24

Inquire

hebei youze biotechnology Co.,Ltd Diamond member

1YR

Products:biotechnology pharmaceutical intermediates biotechnology medical intermediates
Tel:0086-0310-15343106358
Email:guide@cnyouze.com

N-acetylneuraminic acid CAS:131-48-6 Brand：YOUZE

Purity:99%Packing: 200kg/bag FOB
Price: 18 USD/kg
Time: 2022/05/24

Inquire

Hebei Yingong New Material Technology Co.,Ltd. Diamond member

2YRS

Products:xylazine hcl,phenacetin,4-Methylpropiophenone,(2-Bromoethyl)benzene,4-Methoxybenzoyl chloride
Tel:86-311-17798046959
Email:lisa@hbyingong.com

N-Acetylneuraminic acid cas 131-48-6 NANA Sialic Acid Powder Sialomucin

Purity:99%Packing: 200kg/bag FOB
Price: 50 USD/gram
Time: 2022/05/18

Inquire