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N-(2,4-dichlorophenyl)-4-methoxybenzamide

HCID 710656
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Basic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
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Basic information

CAS
313981-28-1
Standard SMILES
COc1ccc(C(=O)Nc2ccc(Cl)cc2Cl)cc1
InChIKey
VIAKRBWYKFRHLD-UHFFFAOYSA-N
Molecular formula
C14H11Cl2NO2
Average molar mass
296.1 g/mol
Monoisotopic mass
295.016684

Names & identifiers

Preferred name
N-(2,4-dichlorophenyl)-4-methoxybenzamide
IUPAC
N-(2,4-dichlorophenyl)-4-methoxybenzamide
English name
N-(2,4-dichlorophenyl)-4-methoxybenzamide
Molecular formula
C14H11Cl2NO2
Molecular weight
296.15

Names & synonyms

N-(2,4-dichlorophenyl)-4-methoxybenzamide313981-28-1starbld0015376Cambridge id 5343423Oprea1_282727STK059107AKOS001604026ST010672AB00081544-01AG-690/10419063SR-01000406879N-(2,4-dichlorophenyl)(4-methoxyphenyl)carboxamide
Show more names
Benzamide, N-(2,4-dichlorophenyl)-4-methoxy-
SR-01000406879-1

Database identifiers

CAS
313981-28-1
PubChem CID
710656
EC Number
169-445-7

Properties

Computed structural properties

XLogP
3.8
Topological polar surface area
38.3 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
2
Rotatable bonds
3
Heavy atoms
19
Formal charge
0
Complexity
306

Physicochemical properties

Boiling point
350.4 · 350.4±42.0 °C(Predicted)
Density
1.369 · 1.369±0.06 g/cm3(Predicted)
pka
11.83 · 11.83±0.70(Predicted)

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)

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

Hazard information

Hazard Classes and CategoriesAquatic Acute 1 (100%)

Chemistry & industry

Suppliers3 total

安耐吉化学&3A(安徽泽升科技有限公司)021-58432009 400-005-6266 · [email protected]
阿法埃莎(中国)化学有限公司400-6106006 · [email protected]
济南思考化学有限公司0531-0000 · [email protected]

Related reactions

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Compound notes

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On this pageBasic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes