Basic information
- Standard SMILES
CCCCCCCCCC[N+](C)(C)Cc1ccccc1.[Cl-]- InChIKey
TTZLKXKJIMOHHG-UHFFFAOYSA-M- Molecular formula
- C19H34ClN
- Average molar mass
- 311.9 g/mol
- Monoisotopic mass
- 311.2379778
Names & identifiers
- Preferred name
- C8-18-Alkydimethylbenzyl ammonium chlorides
- IUPAC
- benzyl-decyl-dimethylazanium chloride
- English name
- Benzyldecyldimethylammonium chloride
- Molecular formula
- C19H34ClN
- Molecular weight
- 311.93
Names & synonyms
Show more names
Database identifiers
- CAS
63449-41-2、965-32-2- PubChem CID
- 13762
- DTXSID
DTXSID7040780- ChEMBL
CHEMBL1878297- EC Number
- 213-521-5
Properties
Computed structural properties
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 11
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 216
Physicochemical properties
- Melting point
- 50 · 50-60 °C
- storage temp.
- 2 · 2-8°C
- solubility
- Chloroform (Slightly), DMSO (Slightly), Methanol (Slightly)
- form
- Solid
- color
- White to Off-White
- BRN
- 3578562 · 3578562
- Stability
- Hygroscopic
- InChI
- 1S/C19H34N.ClH/c1-4-5-6-7-8-9-10-14-17-20(2,3)18-19-15-12-11-13-16-19;/h11-13,15-16H,4-10,14,17-18H2,1-3H3;1H/q+1;/p-1
- InChIKey
- TTZLKXKJIMOHHG-UHFFFAOYSA-M
- SMILES
- [Cl-].CCCCCCCCCC[N+](C)(C)Cc1ccccc1
- EPA Substance Registry System
- Benzenemethanaminium, N-decyl-N,N-dimethyl-, chloride (965-32-2)
- UNSPSC Code
- 77101502 · 77101502
- NACRES
- 24 · NA.24
- 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
- PPE
- 95 · dust mask type N95 (US), Eyeshields, Gloves
- Hazard Codes
- Xi
- Risk Statements
- 36 · 36/37/38
- Safety Statements
- 26 · 26-36
- WGK Germany
- 3 · 3
- F
- 3 · 3-10
- TSCA
- TSCA listed
- Storage Class
- 8 A · 8A - Combustible corrosive hazardous materials
- Hazard Classifications
- 4 OralAquatic · Acute Tox. 4 OralAquatic Acute 1Aquatic Chronic 1Eye Dam. 1Skin Corr. 1B
Safety & regulation
GHS classification
GHS Classification
Warning
H315 (98.2%): Causes skin irritation [Warning Skin corrosion/irritation];H319 (98.2%): Causes serious eye irritation [Warning Serious eye damage/eye irritation];H335 (98.2%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract 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 56 reports by companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.;Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website.
Hazard information
Safety data
- F
- 3-10
- PPE
- dust mask type N95 (US), Eyeshields, Gloves
- wgk
- 3
- tsca
- TSCA listed
- risk_code
- 36/37/38
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_code
- Xi
- safety_code
- 26-36
- Storage Class
- 8A - Combustible corrosive hazardous materials
- Hazard statements
- H315-H319-H335
- Hazard Classifications
- Acute Tox. 4 OralAquatic Acute 1Aquatic Chronic 1Eye Dam. 1Skin Corr. 1B
- Precautionary statements
- P261-P264-P271-P280-P302+P352-P305+P351+P338
Chemistry & industry
Uses & manufacturing
Applications
UsesBenzyldimethyldecylammonium chloride may be used as an analytical reference standard for the determination of the analyte in grapefruit seed extracts, milk samples and food products by chromatography based techniques.
UsesBenzyldecyldimethylammonium Chloride is a biocide.
General DescriptionBenzyldimethyldecylammonium chloride belongs to the benzalkonium (BAC) group of quaternary ammonium compounds (QACs). It is widely used as an antibacterial and antifungal agent for disinfection purposes.
Suppliers36 total
Related reactions
Linked notes
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