Basic information
- Standard SMILES
C=CC(=O)Nc1ccc(Cl)c(Cl)c1- InChIKey
ZILCCQUWYBKBCX-UHFFFAOYSA-N- Molecular formula
- C9H7Cl2NO
- Average molar mass
- 216.06 g/mol
- Monoisotopic mass
- 214.9904692
Names & identifiers
- Preferred name
- N-(3,4-Dichlorophenyl)prop-2-enamide
- IUPAC
- N-(3,4-dichlorophenyl)prop-2-enamide
Names & synonyms
N-(3,4-Dichlorophenyl)prop-2-enamide15271-54-2DTXSID70539938RefChem:361070DTXCID00490725N-(3,4-dichlorophenyl)acrylamideSCHEMBL7286865ZILCCQUWYBKBCX-UHFFFAOYSA-NN-(3,4-dichlorophenyl)-acrylamideN-(3,4-dichlorophenyl) propenamideMFCD00585090AKOS009809681
Show more names
GP-0571CS-0337099
Database identifiers
- CAS
15271-54-2- PubChem CID
- 13411358
- DTXSID
DTXSID70539938- EC Number
- 179-267-1
Properties
Computed structural properties
- XLogP
- 3.8
- Topological polar surface area
- 29.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 2
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 208
Safety & regulation
GHS classification
GHS Classification
Warning
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral];H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation];H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation];H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]
P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+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%);Skin Irrit. 2 (100%);Eye Irrit. 2A (100%);STOT SE 3 (100%)
Related reactions
4 records
Linked notes
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