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N-(benzenesulfonyl)-2-(3-methylphenoxy)acetamide

HCID 765609
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Basic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
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Basic information

CAS
17811-69-7
Standard SMILES
Cc1cccc(OCC(=O)NS(=O)(=O)c2ccccc2)c1
InChIKey
SFZYHNAGMAZZMB-UHFFFAOYSA-N
Molecular formula
C15H15NO4S
Average molar mass
305.4 g/mol
Monoisotopic mass
305.07217913

Names & identifiers

Preferred name
N-(benzenesulfonyl)-2-(3-methylphenoxy)acetamide
IUPAC
N-(benzenesulfonyl)-2-(3-methylphenoxy)acetamide
English name
Acetamide, N-(phenylsulfonyl)-2-(m-tolyloxy)- (8CI)
Molecular formula
C15H15NO4S
Molecular weight
305.35

Names & synonyms

N-(benzenesulfonyl)-2-(3-methylphenoxy)acetamideN-m-Tolyloxyacetyl-benzenesulfonamideOprea1_052116Oprea1_847224SFZYHNAGMAZZMB-UHFFFAOYSA-NDTXSID701334855AKOS00062080717811-69-7EU-00339892-(3-methylphenoxy)-N-(phenylsulfonyl)acetamideSR-01000393527SR-01000393527-1
Show more names
Acetamide, N-(phenylsulfonyl)-2-(m-tolyloxy)- (8CI)
Z56665075

Database identifiers

CAS
17811-69-7
PubChem CID
765609
DTXSID
DTXSID701334855
EC Number
152-864-4

Properties

Computed structural properties

XLogP
2.7
Topological polar surface area
80.9 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
4
Rotatable bonds
5
Heavy atoms
21
Formal charge
0
Complexity
437

Physicochemical properties

Melting point
127 °C · 127 °C
Density
1.281 · 1.281±0.06 g/cm3(Predicted)
pka
4.87 · 4.87±0.10(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

Danger

H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P354+P338, P317, P319, P321, P330, P332+P317, P362+P364, P403+P233, P405, 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 CategoriesAcute Tox. 4 (100%)

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