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2-(3-Methylphenoxy)acetic acid 2-((3-methoxyphenyl)methylene)hydrazide

HCID 758558
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Basic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
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Basic information

CAS
303065-18-1
Standard SMILES
COc1cccc(C=NNC(=O)COc2cccc(C)c2)c1
InChIKey
QSYCVNWOQGAXLW-UHFFFAOYSA-N
Molecular formula
C17H18N2O3
Average molar mass
298.34 g/mol
Monoisotopic mass
298.13174244

Names & identifiers

Preferred name
2-(3-Methylphenoxy)acetic acid 2-((3-methoxyphenyl)methylene)hydrazide
IUPAC
N-[(3-methoxyphenyl)methylideneamino]-2-(3-methylphenoxy)acetamide
English name
N'-[(1E)-(3-methoxyphenyl)methylidene]-2-(3-methylphenoxy)acetohydrazide
Molecular formula
C17H18N2O3
Molecular weight
298.34

Names & synonyms

303065-18-12-(3-Methylphenoxy)acetic acid 2-[(3-methoxyphenyl)methylene]hydrazide2-(3-Methylphenoxy)acetic acid 2-((3-methoxyphenyl)methylene)hydrazideRefChem:251664N'-[(3-Methoxyphenyl)methylidene]-2-(3-methylphenoxy)acetohydrazideDTXSID901153657N'-(3-METHOXYBENZYLIDENE)-2-(3-METHYLPHENOXY)ACETOHYDRAZIDEN'-(3-METHOXYBENZYLIDENE)-2-(3-METHYLPHENOXY)ACETOHYDRAZIDEN'-[(1E)-(3-methoxyphenyl)methylidene]-2-(3-methylphenoxy)acetohydrazide

Database identifiers

CAS
303065-18-1
PubChem CID
758558
DTXSID
DTXSID901153657
EC Number
658-193-8

Properties

Computed structural properties

XLogP
3.2
Topological polar surface area
59.9 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
4
Rotatable bonds
6
Heavy atoms
22
Formal charge
0
Complexity
373

Physicochemical properties

Density
1.117 · 1.117±0.14 g/cm3(Temp: 25 °C; Press: 760 Torr)(predicted)
pka
12.011 · 12.011±0.46(predicted)
Symbol(GHS)
9 · GHS09
Signal word
Warning
Hazard statements
400 · H400
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 38 reports by companies from 1 notifications to the ECHA C&L Inventory.

Hazard information

Hazard Classes and CategoriesAquatic Acute 1 (100%)

Safety data

Signal word
Warning
Symbol(GHS)
GHS09
Hazard statements
H400
Precautionary statements
P273-P391-P501

Chemistry & industry

Suppliers1 total

西格玛奥德里奇(上海)贸易有限公司21-20338288 · [email protected]

Related reactions

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Compound notes

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