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1-(2,4-Dichlorobenzoyl)-1,2,3,4-tetrahydroquinoline

HCID 599544
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Basic information

CAS
306766-49-4
Standard SMILES
O=C(c1ccc(Cl)cc1Cl)N1CCCc2ccccc21
InChIKey
ZJHFAQJNPFTPQQ-UHFFFAOYSA-N
Molecular formula
C16H13Cl2NO
Average molar mass
306.2 g/mol
Monoisotopic mass
305.0374194

Names & identifiers

Preferred name
1-(2,4-Dichlorobenzoyl)-1,2,3,4-tetrahydroquinoline
IUPAC
(2,4-dichlorophenyl)-(3,4-dihydro-2H-quinolin-1-yl)methanone
English name
1-(2,4-dichlorobenzoyl)-1,2,3,4-tetrahydroquinoline
Molecular formula
C16H13Cl2NO
Molecular weight
306.19

Names & synonyms

306766-49-41-(2,4-Dichlorobenzoyl)-1,2,3,4-tetrahydroquinolineDTXSID80344797RefChem:222827DTXCID40295872645-297-3(2,4-dichlorophenyl)(3,4-dihydroquinolin-1(2H)-yl)methanone(2,4-dichlorophenyl)-(3,4-dihydro-2H-quinolin-1-yl)methanoneZJHFAQJNPFTPQQ-UHFFFAOYSA-NCambridge id 5246806Oprea1_053065Oprea1_189939
Show more names
Methanone, (2,4-dichlorophenyl)(3,4-dihydro-1(2H)-quinolinyl)-
STK051749AKOS000489984ST45037111ST50520481AK-968/40097409SR-01000412352SR-01000412352-12,4-dichlorophenyl 1,2,3,4-tetrahydroquinolyl ketone

Database identifiers

CAS
306766-49-4
PubChem CID
599544
DTXSID
DTXSID80344797
EC Number
645-297-3

Properties

Computed structural properties

XLogP
4.6
Topological polar surface area
20.3 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
1
Rotatable bonds
1
Heavy atoms
20
Formal charge
0
Complexity
362

Physicochemical properties

Symbol(GHS)
9 · GHS09
Signal word
Warning
Hazard statements
410 · H410
Precautionary statements
273 · P273-P391-P501

Safety & regulation

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

GHS classification

GHS Classification · 4 items

Warning

H400 (100%): Very toxic to aquatic life [Warning Hazardous to the aquatic environment, acute hazard]

P273, P391, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 39 reports by companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Hazard information

Hazard Classes and CategoriesAquatic Acute 1 (100%)

Safety data

Signal word
Warning
Symbol(GHS)
GHS09
Hazard statements
H410
Precautionary statements
P273-P391-P501

Related reactions

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Compound notes

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