Basic information
- CAS
18085-76-2- Standard SMILES
Cc1cccc(C)c1NC(=O)CCCl- InChIKey
VOTVVKNPQNCBKS-UHFFFAOYSA-N- Molecular formula
- C11H14ClNO
- Average molar mass
- 211.69 g/mol
Names & identifiers
- Preferred name
- 3-Chloro-2',6'-propionoxylidide
- IUPAC
- 3-chloro-N-(2,6-dimethylphenyl)propanamide
- English name
- 3-chloro-N-(2,6-dimethylphenyl)propanamide
- Molecular formula
- C11H14ClNO
- Molecular weight
- 211.68796
Names & synonyms
18085-76-23-Chloro-2',6'-PropionoxylidideRefChem:499664652-150-73-chloro-N-(2,6-dimethylphenyl)propanamideSCHEMBL6924499VOTVVKNPQNCBKS-UHFFFAOYSA-NAKOS0001453313-chloro-2',6'-dimethylpropionanilide3-chloro-2', 6'-dimethylpropionanilideDA-09052N-(2,6-Dimethylphenyl)-3-chloropropanamide
Show more names
Propanamide, 3-chloro-N-(2,6-dimethylphenyl)-
Database identifiers
- CAS
18085-76-2- PubChem CID
- 4550832
- EC Number
- 652-150-7
Properties
Computed structural properties
- XLogP
- 1.8
- Topological polar surface area
- 29.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 3
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 186
Physicochemical properties
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 319 · H319-H302
- Precautionary statements
- 264 · P264-P280-P305+P351+P338-P337+P313P-P264-P270-P301+P312-P330-P501
Safety & regulation
GHS classification
GHS Classification
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 38 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
- Hazard statements
- H319-H302
- Precautionary statements
- P264-P280-P305+P351+P338-P337+P313P-P264-P270-P301+P312-P330-P501
Chemistry & industry
Suppliers1 total
常州千艾生物科技有限公司051915240519135 13961152745 · [email protected]
Related reactions
9 records
Compound notes
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