N-Allyl-2-iodobenzamide
Basic information
- CAS
66896-70-6- Standard SMILES
C=CCNC(=O)c1ccccc1I- InChIKey
OLXWXYYAYYVWJV-UHFFFAOYSA-N- Molecular formula
- C10H10INO
- Average molar mass
- 287.1 g/mol
Names & identifiers
- Preferred name
- N-Allyl-2-iodobenzamide
- IUPAC
- 2-iodo-N-prop-2-enylbenzamide
- English name
- 2-iodo-N-(prop-2-en-1-yl)benzamide
- Molecular formula
- C10H10INO
- Molecular weight
- 287.1
Names & synonyms
N-Allyl-2-iodobenzamide66896-70-6RefChem:828946665-558-52-iodo-N-prop-2-enylbenzamide2-iodo-N-(prop-2-en-1-yl)benzamide2-iodo-benzoic acid allylamideSCHEMBL4559294OLXWXYYAYYVWJV-UHFFFAOYSA-NSTK201930AKOS003331114SR-01000262601
Show more names
Benzamide, 2-iodo-N-2-propen-1-yl-
SR-01000262601-1
Database identifiers
- CAS
66896-70-6- PubChem CID
- 2190306
- EC Number
- 665-558-5
- Nikkaji
- J1.835.117J
Properties
Computed structural properties
- XLogP
- 2
- Topological polar surface area
- 29.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 3
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 193
Physicochemical properties
- Boiling point
- 367 · 367.0±35.0 °C(Predicted)
- Density
- 1.595 · 1.595±0.06 g/cm3(Predicted)
- pka
- 13.92 · 13.92±0.46(Predicted)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302
- Precautionary statements
- 264 · P264-P270-P301+P312-P330-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
Warning
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P264, P270, P301+P317, P330, 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.
Hazard information
Hazard Classes and CategoriesAcute Tox. 4 (100%)
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302
- Precautionary statements
- P264-P270-P301+P312-P330-P501
Related reactions
5 records
Compound notes
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