2-bromo-N-ethylacetamide
Basic information
- CAS
5327-00-4- Standard SMILES
CCNC(=O)CBr- InChIKey
XZHKIYIYQHCBED-UHFFFAOYSA-N- Molecular formula
- C4H8BrNO
- Average molar mass
- 166.02 g/mol
- Monoisotopic mass
- 164.97893
Names & identifiers
- Preferred name
- 2-bromo-N-ethylacetamide
- IUPAC
- 2-bromo-N-ethylacetamide
- English name
- 2-bromo-N-ethyl-acetamide
- Molecular formula
- C4H8BrNO
- Molecular weight
- 166.02
Names & synonyms
2-Bromo-N-ethylacetamideDTXSID00277775RefChem:467167DTXCID90228933848-119-45327-00-4Acetamide, 2-bromo-N-ethyl-2-bromo-n-ethyl-acetamideMFCD06800147N-ethylbromoacetamide2-Bromo-N-ethyl-ethanamideNSC4095
Show more names
2-bromo-N-ethylacetamide(SALTDATA: FREE)N-(Bromoacetyl)ethylamine, 2-Bromo-N-ethylethanamide
SCHEMBL799740SCHEMBL10666002XZHKIYIYQHCBED-UHFFFAOYSA-NALBB-011962NSC-4095SBB051008STL0669332-Bromo-N-ethylacetamide, AldrichCPR
Database identifiers
- CAS
5327-00-4- PubChem CID
- 220792
- DTXSID
DTXSID00277775- EC Number
- 848-119-4
- Nikkaji
- J1.586.235A
Properties
Computed structural properties
- XLogP
- 0.3
- Topological polar surface area
- 29.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 2
- Heavy atoms
- 7
- Formal charge
- 0
- Complexity
- 64.7
Experimental & physicochemical properties
LogP0.34
Physicochemical properties
- storage temp.
- 2 · Storage temp. 2-8°C
- form
- solid
- Appearance
- Off-white to light yellow Solid-Liquid Mixture
- InChI
- 1S/C4H8BrNO/c1-2-6-4(7)3-5/h2-3H2,1H3,(H,6,7)
- InChIKey
- XZHKIYIYQHCBED-UHFFFAOYSA-N
- SMILES
- O=C(CBr)NCC
- UNSPSC Code
- 12352200 · 12352200
- NACRES
- 21 · NA.21
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302+H312+H332-H315-H319-H335
- Precautionary statements
- 280 · P280
- WGK Germany
- 3 · WGK 3
- HazardClass
- IRRITANT
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
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P354+P338, P317, P319, P321, P332+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 2 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Hazard Classes and CategoriesSkin Irrit. 2 (100%)
Safety data
- wgk
- WGK 3
- hs_code
- 2924297099
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_class
- IRRITANT
- Storage Class
- 11 - Combustible Solids
- Hazard statements
- H302+H312+H332-H315-H319-H335
- Precautionary statements
- P280
Chemistry & industry
Applications
Uses2-Bromo-N-ethylacetamide may be useful in the preparation of dihydrocyclopentaisoquinolinesulfonamide derivatives for treatment or prevention of disorders related to IgE.
Suppliers
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Related reactions
3 records
Compound notes
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