N-Butylbenzamide
Basic information
- CAS
2782-40-3- Standard SMILES
CCCCNC(=O)c1ccccc1- InChIKey
BAULSHLTGVOYKM-UHFFFAOYSA-N- Molecular formula
- C11H15NO
- Average molar mass
- 177.24 g/mol
- Monoisotopic mass
- 177.1153641
Overview
Benzamide, N-butyl- has been reported in Rhaphidophora decursiva with data available.
Names & identifiers
- Preferred name
- N-Butylbenzamide
- IUPAC
- N-butylbenzamide
- English name
- N-butylbenzamide
- Molecular formula
- C11H15NO
- Molecular weight
- 177.24
Names & synonyms
N-ButylbenzamideBenzamide, N-butyl-ButylbenzamideEINECS 220-485-4NSC 26916BRN 2045962AI3-00818DTXSID701821403-09-00-01071 (Beilstein Handbook Reference)RefChem:163054N-ButylbenzenecarboximidateDTXCID80104631
Show more names
220-485-4BAULSHLTGVOYKM-UHFFFAOYSA-N2782-40-3N-n-ButylbenzamideN-butyl-benzamideMFCD00956665NSC26916WLN: 4MVR
Database identifiers
- CAS
2782-40-3- PubChem CID
- 76024
- DTXSID
DTXSID70182140- ChEMBL
CHEMBL444703- EC Number
- 220-485-4
- Nikkaji
- J54.485J
Properties
Computed structural properties
- XLogP
- 2.1
- Topological polar surface area
- 29.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 4
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 150
Physicochemical properties
- Melting point
- 41 · 41-42 °C
- Boiling point
- 128 °C · 128 °C(Press: 0.5 Torr)
- Density
- 0.988 · 0.988±0.06 g/cm3(Predicted)
- pka
- 15 · 15.00±0.46(Predicted)
- Symbol(GHS)
- 5 · GHS05
- Signal word
- Danger
- Hazard statements
- 318 · H318
- Precautionary statements
- 280 · P280-P305+P351+P338-P310
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
H318 (97.6%): Causes serious eye damage [Danger Serious eye damage/eye irritation]
P264+P265, P280, P305+P354+P338, and P317 (click each P-code to see the statement)
Aggregated GHS information provided per 41 reports by companies from 2 notifications to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesEye Dam. 1 (97.6%)
Safety data
- Signal word
- Danger
- Symbol(GHS)
- GHS05
- Hazard statements
- H318
- Precautionary statements
- P280-P305+P351+P338-P310
Chemistry & industry
Upstream & downstream products
Downstream products
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Related reactions
2 records
Compound notes
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