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N-(2,4,5-Trichlorophenyl)acetamide

HCID 90217
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Basic information

CAS
23627-24-9
Standard SMILES
CC(=O)Nc1cc(Cl)c(Cl)cc1Cl
InChIKey
VUSLTUGEJURGLB-UHFFFAOYSA-N
Molecular formula
C8H6Cl3NO
Average molar mass
238.5 g/mol
Monoisotopic mass
236.951497

Names & identifiers

Preferred name
N-(2,4,5-Trichlorophenyl)acetamide
IUPAC
N-(2,4,5-trichlorophenyl)acetamide
English name
2,4,5-Trichloroacetanilide
Molecular formula
C8H6Cl3NO
Molecular weight
238.5

Names & synonyms

N-(2,4,5-Trichlorophenyl)acetamide23627-24-92',4',5'-TrichloroacetanilideAcetanilide, 2',4',5'-trichloro-2,4,5-TrichlorophenylacetamideEINECS 245-793-6BRN 2939702DTXSID701783013-12-00-01409 (Beilstein Handbook Reference)N-[2,4,5-trichlorophenyl]acetamideNSC 80150RefChem:823890
Show more names
2’,4’,5’-trichloro-acetanilid2'',4'',5''-TRICHLOROACETANILIDE 98+%
DTXCID60100792245-793-62,4,5-TrichloroacetanilideAcetamide, N-(2,4,5-trichlorophenyl)-MFCD00018123NSC-80150NSC801509LRE3YGL34

Database identifiers

CAS
23627-24-9
PubChem CID
90217
DTXSID
DTXSID70178301
UNII
9LRE3YGL34
EC Number
245-793-6
Nikkaji
J242.635H

Properties

Computed structural properties

XLogP
3.2
Topological polar surface area
29.1 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
1
Rotatable bonds
1
Heavy atoms
13
Formal charge
0
Complexity
200

Physicochemical properties

Melting point
186 · 186-188°C
Boiling point
374 · 374.0±42.0 °C(Predicted)
Density
1.505 · 1.505±0.06 g/cm3(Predicted)
RTECS
7890200 · AE7890200
pka
12.65 · 12.65±0.70(Predicted)
EWG's Food Scores
1 · 1
Symbol(GHS)
7 · GHS07
Signal word
Warning
Hazard statements
319 · H319-H302
Precautionary statements
264 · P264-P270-P301+P312-P330-P501-P264-P280-P305+P351+P338-P337+P313P
Safety Statements
22 · 22-24/25

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

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

P264, P264+P265, P270, P280, P301+P317, P305+P351+P338, P330, P337+P317, 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 CategoriesAcute Tox. 4 (100%)

Safety data

Signal word
Warning
Symbol(GHS)
GHS07
safety_code
22-24/25
Hazard statements
H319-H302
Precautionary statements
P264-P270-P301+P312-P330-P501-P264-P280-P305+P351+P338-P337+P313P

Chemistry & industry

Upstream & downstream products

Upstream raw materials

Ethanone, 1-(2,4,5-trichlorophenyl)-, oxime2',3',4'-Trichloroacetanilide2',5'-Dichloroacetanilide3,4-DichloroacetanilideSodium acetateAcetyl chloride

Downstream products

Acetamide, N-(2,3,6-trichlorophenyl)-2,4,5-Trichloroaniline

Related reactions

1 records
New reaction record
HRID 1577620 reaction equation
HRID 1577620As productuspto-grants-1981_09

Compound notes

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