HomeMCPWorkbenchSkills
HomeWorkbenchNotificationsMe
llms.txt · MCP GuidePrivacy Policy · Terms of Service · Supportv1.8.0
  1. Home
  2. /Compound

1(2H)-Quinolineethanol, 6-(2-(2-chloro-4-(methylsulfonyl)phenyl)diazenyl)-3,4-dihydro-2,2,4,7-tetramethyl-

HCID 112579
New noteNew reactionRequest quotes
Print preview

Completing data — refresh the page later to see the latest

Basic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

CAS
63134-03-2
Standard SMILES
Cc1cc2c(cc1N=Nc1ccc(S(C)(=O)=O)cc1Cl)C(C)CC(C)(C)N2CCO
InChIKey
HOOCPUZKGIXXDM-UHFFFAOYSA-N
Molecular formula
C22H28ClN3O3S
Average molar mass
450 g/mol
Monoisotopic mass
449.1539906

Names & identifiers

Preferred name
1(2H)-Quinolineethanol, 6-(2-(2-chloro-4-(methylsulfonyl)phenyl)diazenyl)-3,4-dihydro-2,2,4,7-tetramethyl-
IUPAC
2-[6-[(2-chloro-4-methylsulfonylphenyl)diazenyl]-2,2,4,7-tetramethyl-3,4-dihydroquinolin-1-yl]ethanol
English name
6-[[2-chloro-4-(methylsulphonyl)phenyl]azo]-3,4-dihydro-2,2,4,7-tetramethyl-2H-quinoline-1-ethanol
Molecular formula
C22H28ClN3O3S
Molecular weight
449.99

Names & synonyms

EINECS 263-907-2DTXSID508669711(2H)-Quinolineethanol, 6-(2-(2-chloro-4-(methylsulfonyl)phenyl)diazenyl)-3,4-dihydro-2,2,4,7-tetramethyl-1(2H)-Quinolineethanol, 6-((2-chloro-4-(methylsulfonyl)phenyl)azo)-3,4-dihydro-2,2,4,7-tetramethyl-1(2H)-Quinolineethanol, 6-[2-[2-chloro-4-(methylsulfonyl)phenyl]diazenyl]-3,4-dihydro-2,2,4,7-tetramethyl-1(2H)-Quinolineethanol, 6-[[2-chloro-4-(methylsulfonyl)phenyl]azo]-3,4-dihydro-2,2,4,7-tetramethyl-RefChem:408825DTXCID0081519663134-03-2HOOCPUZKGIXXDM-OCOZRVBESA-NHOOCPUZKGIXXDM-UHFFFAOYSA-NDB-307773
Show more names
6-[[2-Chloro-4-(methylsulfonyl)phenyl]azo]-3,4-dihydro-2,2,4,7-tetramethyl-1(2H)-quinolineethanol6-[[2-chloro-4-(methylsulphonyl)phenyl]azo]-3,4-dihydro-2,2,4,7-tetramethyl-2H-quinoline-1-ethanol1(2H)-Quinolineethanol, 6-[[2-chloro-4-(methylsulfonyl) phenyl]azo]-3,4-dihydro-2,2,4,7-tetramethyl -
DB-325475NS00055635Cyclohexanecarbonyl chloride,4-cyano-,trans-(9CI)2-[6-{[2-Chloro-4-(methanesulfonyl)phenyl]diazenyl}-2,2,4,7-tetramethyl-3,4-dihydroquinolin-1(2H)-yl]ethan-1-ol6-((2-Chloro-4-(methylsulphonyl)phenyl)azo)-3,4-dihydro-2,2,4,7-tetramethyl-2H-quinoline-1-ethanol6-[[2-CHLORO-4-(METHYLSULPHONYL)PHENYL ]AZO]-3,4-DIHYDRO-2,2,4,7-TETRAMETHYL-2H-QUINOLINE-1-ETHANOL

Properties

Computed structural propertiesFilling in

XLogP
4.7
Topological polar surface area
90.7 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
6
Rotatable bonds
5
Heavy atoms
30
Formal charge
0
Complexity
724

Physicochemical properties

EPA Substance Registry System
1 · 1(2H)-Quinolineethanol, 6-[[2-chloro-4-(methylsulfonyl)phenyl]azo]-3,4-dihydro-2,2,4,7-tetramethyl- (63134-03-2)
TSCA
TSCA listed

Safety & regulation

Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.

Safety data

tsca
TSCA listed

Chemistry & industry

Uses & manufacturing

General Manufacturing Information1(2H)-Quinolineethanol, 6-[2-[2-chloro-4-(methylsulfonyl)phenyl]diazenyl]-3,4-dihydro-2,2,4,7-tetramethyl-: INACTIVE

Related reactions

0 records
New reaction record

No reaction records under the current filter.

Compound notes

Loading…

On this pageBasic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
More actions
New noteNew reactionRequest quotes

Database identifiers

CAS
63134-03-2
PubChem CID
112579
DTXSID
DTXSID50866971
EC Number
263-907-2
Nikkaji
J326.974D