Basic information
- CAS
5875-26-3- Standard SMILES
NC(=O)CCCCCCCCCCBr- InChIKey
NHUWVMSJSKNFHL-UHFFFAOYSA-N- Molecular formula
- C11H22BrNO
- Average molar mass
- 264.2 g/mol
- Monoisotopic mass
- 263.08847642
Names & identifiers
- Preferred name
- 11-Bromoundecanamide
- IUPAC
- 11-bromoundecanamide
- English name
- 11-Bromoundecanamide 97
- Molecular formula
- C11H22BrNO
- Molecular weight
- 264.2
Names & synonyms
11-BromoundecanamideDTXSID60323166RefChem:437222DTXCID602742855875-26-3Undecanamide, 11-bromo-NSC40323511-Bromoundecanamide #11-Bromoundecanamide, 97%SCHEMBL5573307MFCD06411366AKOS015913278
Show more names
11-Bromoundecanamide 9711-Bromoundecanamide 97%
NSC 403235NSC-403235AS-87497H55001
Database identifiers
- CAS
5875-26-3- PubChem CID
- 345548
- DTXSID
DTXSID60323166- EC Number
- 806-324-6
- Nikkaji
- J2.353.419C
Properties
Computed structural properties
- XLogP
- 3.6
- Topological polar surface area
- 43.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 10
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 139
Physicochemical properties
- Melting point
- 88 · 88-92 °C(lit.)
- Boiling point
- 383.5 · 383.5±15.0 °C(Predicted)
- Density
- 1.178 · 1.178±0.06 g/cm3(Predicted)
- pka
- 16.61 · 16.61±0.40(Predicted)
- form
- solid
- InChI
- 1S/C11H22BrNO/c12-10-8-6-4-2-1-3-5-7-9-11(13)14/h1-10H2,(H2,13,14)
- InChIKey
- NHUWVMSJSKNFHL-UHFFFAOYSA-N
- SMILES
- NC(=O)CCCCCCCCCCBr
- UNSPSC Code
- 12352100 · 12352100
- NACRES
- 22 · NA.22
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 315 · H315-H319-H335
- Precautionary statements
- 261 · P261-P264-P271-P280-P302+P352-P305+P351+P338
- target organs
- Respiratory system
- Hazard Codes
- Xi
- Risk Statements
- 36 · 36/37/38
- Safety Statements
- 26 · 26-36
- WGK Germany
- 3 · 3
- Storage Class
- 11 · 11 - Combustible Solids
- Hazard Classifications
- 2 Skin · Eye Irrit. 2Skin Irrit. 2STOT SE 3
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
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 39 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
- 3
- risk_code
- 36/37/38
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_code
- Xi
- safety_code
- 26-36
- Storage Class
- 11 - Combustible Solids
- target organs
- Respiratory system
- Hazard statements
- H315-H319-H335
- Hazard Classifications
- Eye Irrit. 2Skin Irrit. 2STOT SE 3
- Precautionary statements
- P261-P264-P271-P280-P302+P352-P305+P351+P338
Chemistry & industry
Suppliers10 total
宁波季诺化学品有限公司0574-87314919 057487319282 · [email protected]
上海仲因实业有限公司2537653158 16621191650 · [email protected]
安耐吉化学&3A（安徽泽升科技股份有限公司）400-0056266 · [email protected]
Sigma-Aldrich西格玛奥德里奇(上海)贸易有限公司021-61415566 800-8193336 · [email protected]
上海阿拉丁生化科技股份有限公司6206333 13167063860 · [email protected]
陕西缔都医药化工有限公司+86-29-81139210 +86-17392587031 · [email protected]
上海源叶生物科技有限公司18916372613 · [email protected]
河南威梯希化工科技有限公司0371-63284658 18135795563 · [email protected]
Aladdin Scientific[email protected]
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]
Related reactions
1 records
Compound notes
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