Basic information
- CAS
74863-82-4- Standard SMILES
Cc1cnc2c(S(=O)(=O)Cl)cccc2c1- InChIKey
XCMAYGDQKTWICK-UHFFFAOYSA-N- Molecular formula
- C10H8ClNO2S
- Average molar mass
- 241.69 g/mol
- Monoisotopic mass
- 240.99642718
Names & identifiers
- Preferred name
- 3-methylquinoline-8-sulfonyl Chloride
- IUPAC
- 3-methylquinoline-8-sulfonyl chloride
- English name
- 3-Methyl-8-quinolinesulphonyl chloride
- Molecular formula
- C10H8ClNO2S
- Molecular weight
- 241.69
Names & synonyms
74863-82-43-methylquinoline-8-sulfonyl Chloride3-METHYL-8-QUINOLINESULFONYL CHLORIDEDTXSID00393787RefChem:504352DTXCID90344647616-150-03-Methyl-8-quinolinesulphonyl chlorideMFCD026833678-Chlorosulfonyl-3-methylquinoline8-Quinolinesulfonyl chloride, 3-methyl-Argatroban Impurity 37
Show more names
Argatroban Impurity 29Argatraban IntermediateArgatraban Intermediate -23-Methylquinoline-8-sulfonyl3-methylquinoline-3-sulfonyl chloride3-METHYL-8-QUINOLINE SULPHONYL CHLORIDE3-methyl quinoline-8-sulphonyl chloride
3-METHYL-QUINOLINE-8-SULFONYL CHLORIDED6J3GW33J6SCHEMBL11611613-Methyl-8-quinolinesulphonylchlorideAKOS009116157CS-W023078FM25759SB12302
Database identifiers
- CAS
74863-82-4- PubChem CID
- 3574807
- DTXSID
DTXSID00393787
Properties
Computed structural properties
- XLogP
- 2.2
- Topological polar surface area
- 55.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 325
Physicochemical properties
- Melting point
- 158 · 158-159°C
- Boiling point
- 371.5 · 371.5±27.0 °C(Predicted)
- Density
- 1.424 · 1.424±0.06 g/cm3(Predicted)
- storage temp.
- 2 · Inert atmosphere,2-8°C
- solubility
- Chloroform (Slightly), Ethyl Acetate (Slightly), Methanol (Very Slightly)
- form
- Solid
- pka
- 0.82 · 0.82±0.28(Predicted)
- color
- White to Pale Brown
- Stability
- Moisture Sensitive - Store Under Inert Atmosphere
- InChI
- InChI=1S/C10H8ClNO2S/c1-7-5-8-3-2-4-9(15(11,13)14)10(8)12-6-7/h2-6H,1H3
- InChIKey
- XCMAYGDQKTWICK-UHFFFAOYSA-N
- SMILES
- N1C2C(=CC=CC=2S(Cl)(=O)=O)C=C(C)C=1
- CAS DataBase Reference
- 74863 · 74863-82-4(CAS DataBase Reference)
- FDA UNII
- 6 J3GW33J6 · D6J3GW33J6
- Symbol(GHS)
- 7 · GHS07
Safety & regulation
GHS classification
GHS Classification
This chemical does not meet GHS hazard criteria for 16.7% (1 of 6) of reports.
Danger
H314 (50%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]
P260, P264, P264+P265, P280, P301+P330+P331, P302+P361+P354, P304+P340, P305+P351+P338, P305+P354+P338, P316, P317, P321, P337+P317, P363, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 6 reports by companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Hazard Classes and CategoriesSkin Corr. 1C (50%)
Safety data
- hs_code
- 29349990
- risk_code
- 36
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_code
- Xi
- safety_code
- 26-24/25
- Hazard statements
- H315-H319
- Precautionary statements
- P264-P280-P302+P352-P305+P351+P338-P332+P313-P337+P313-P362
Chemistry & industry
Applications
Uses3-Methyl-8-quinolinesulfonyl Chloride (cas# 74863-82-4) is a compound useful in organic synthesis.
Upstream & downstream products
Upstream raw materials
Downstream products
Suppliers100 total
湖北永阔科技有限公司027-59223108 15972152991 · [email protected]
Shandong chuangyingchemical Co., Ltd.18853181302 · [email protected]
上海策嵘生物科技有限公司[email protected]
Career Henan Chemica Co+86-0371-86658258 +86-13203830695 · [email protected]
Changzhou Carman Chemical Co., Ltd.15061933924
Related reactions
4 records
Compound notes
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