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2-({[3-(2,2-Dichloroethenyl)-2,2-dimethylcyclopropyl]carbonyl}amino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide

HCID 3118317
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Basic informationNames & identifiersPropertiesSafety & regulationRelated reactionsCompound notes
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Basic information

CAS
297146-34-0
Standard SMILES
CC1(C)C(C=C(Cl)Cl)C1C(=O)Nc1sc2c(c1C(N)=O)CCCC2
InChIKey
AYKAFPCYVLBBNK-UHFFFAOYSA-N
Molecular formula
C17H20Cl2N2O2S
Average molar mass
387.3 g/mol
Monoisotopic mass
386.0622544

Names & identifiers

Preferred name
2-({[3-(2,2-Dichloroethenyl)-2,2-dimethylcyclopropyl]carbonyl}amino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
IUPAC
2-[[3-(2,2-dichloroethenyl)-2,2-dimethylcyclopropanecarbonyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide

Names & synonyms

297146-34-02-({[3-(2,2-dichloroethenyl)-2,2-dimethylcyclopropyl]carbonyl}amino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide2-({[3-(2,2-DICHLOROVINYL)-2,2-DIMETHYLCYCLOPROPYL]CARBONYL}AMINO)-4,5,6,7-TETRAHYDRO-1-BENZOTHIOPHENE-3-CARBOXAMIDESTK809699AKOS001608023AKOS016289446AH-034/116502582-(3-(2,2-dichlorovinyl)-2,2-dimethylcyclopropanecarboxamido)-4,5,6,7-tetrahydrobenzo[b]thiophene-3-carboxamide2-{[3-(2,2-dichloroethenyl)-2,2-dimethylcyclopropane-1-carbonyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide

Database identifiers

CAS
297146-34-0
PubChem CID
3118317
EC Number
169-067-2

Properties

Computed structural properties

XLogP
4.7
Topological polar surface area
100 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
3
Rotatable bonds
4
Heavy atoms
24
Formal charge
0
Complexity
577

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

H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]

P264+P265, P273, P280, P305+P351+P338, P337+P317, and P501 (click each P-code to see the statement)

The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.

Hazard information

Hazard Classes and CategoriesEye Irrit. 2 (100%)

Related reactions

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Compound notes

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On this pageBasic informationNames & identifiersPropertiesSafety & regulationRelated reactionsCompound notes