Basic information
- CAS
20781-87-7- Standard SMILES
Cc1cccc(C(C)C)c1NC(=O)CCl- InChIKey
MELPBOXLVQNGPR-UHFFFAOYSA-N- Molecular formula
- C12H16ClNO
- Average molar mass
- 225.71 g/mol
- Monoisotopic mass
- 225.0920418
Names & identifiers
- Preferred name
- 2-Chloro-N-[2-methyl-6-(propan-2-yl)phenyl]acetamide
- IUPAC
- 2-chloro-N-(2-methyl-6-propan-2-ylphenyl)acetamide
- English name
- 2-Chloro-N-(2-isopropyl-6-methyl-phenyl)-acetamide
- Molecular formula
- C12H16ClNO
- Molecular weight
- 225.71
Names & synonyms
2-Chloro-N-[2-methyl-6-(propan-2-yl)phenyl]acetamideDTXSID803269322-chloro-N-(2-methyl-6-(propan-2-yl)phenyl)acetamideRefChem:470275DTXCID00278045966-082-320781-87-72-Chloro-N-(2-isopropyl-6-methylphenyl)acetamideMFCD023491072-chloro-N-(2-methyl-6-propan-2-ylphenyl)acetamide2-CHLORO-N-(2-ISOPROPYL-6-METHYL-PHENYL)-ACETAMIDEAcetamide, 2-chloro-N-[2-methyl-6-(1-methylethyl)phenyl]-
Show more names
2-Chloro-N-[2-methyl-6-(1-methylethyl)phenyl]acetamide2-chloro-N-(2-isopropyl-6-methylphenyl)acetamide(SALTDATA: FREE)
2-chloro-N-[6-methyl-2-(methylethyl)phenyl]acetamideNSC622317CHEMBL1985086SCHEMBL10948543Acetamide,2-chloro-N-[2-methyl-6-(1-methylethyl)phenyl]-SBB015290AKOS000268691JS-3002
Database identifiers
- CAS
20781-87-7- PubChem CID
- 360283
- DTXSID
DTXSID80326932- ChEMBL
CHEMBL1985086- EC Number
- 966-082-3
Properties
Computed structural properties
- XLogP
- 3.2
- Topological polar surface area
- 29.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 3
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 218
Physicochemical properties
- Symbol(GHS)
- 5 · GHS05,GHS07
- Signal word
- Danger
- Hazard statements
- 302 · H302-H312-H315-H318-H332-H335
- Precautionary statements
- 261 · P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P310-P330-P332+P313-P362-P403+P233-P405-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
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%)
Safety data
- Signal word
- Danger
- Symbol(GHS)
- GHS05,GHS07
- Hazard statements
- H302-H312-H315-H318-H332-H335
- Precautionary statements
- P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P310-P330-P332+P313-P362-P403+P233-P405-P501
Chemistry & industry
Suppliers3 total
深圳聚合生化科技有限公司+86-400-002-6226 13028896684 · [email protected]
常州千艾生物科技有限公司051915240519135 13961152745 · [email protected]
北京百灵威科技有限公司18210857532 18210857532 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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