Basic information
- CAS
2425-54-9- Standard SMILES
CCCCCCCCCCCCCCCl- InChIKey
RNHWYOLIEJIAMV-UHFFFAOYSA-N- Molecular formula
- C14H29Cl
- Average molar mass
- 232.83 g/mol
- Monoisotopic mass
- 232.1957786
Names & identifiers
- Preferred name
- Myristyl chloride
- IUPAC
- 1-chlorotetradecane
- English name
- 1-Chlorotetradecane
- Molecular formula
- C14H29Cl
- Molecular weight
- 232.83
Names & synonyms
Show more names
Database identifiers
- CAS
2425-54-9- PubChem CID
- 17043
- DTXSID
DTXSID1027471- ChEMBL
CHEMBL3184755- UNII
- 97D1SF0719
- EC Number
- 219-368-0
- Nikkaji
- J97.518D
Properties
Computed structural properties
- XLogP
- 7.9
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 0
- Rotatable bonds
- 12
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 102
Experimental & physicochemical properties
Kovats Retention Index
1659.8;1668;1673.9;1662;1674
1666
1886;1890;1889;1873
Physicochemical properties
- Melting point
- -3 °C · -3 °C
- Boiling point
- 295 °C · 295 °C
- Density
- 0.86 · 0.86
- refractive index
- 1.446 · 1.446-1.448
- Flash point
- 130 °C · 130 °C
- storage temp.
- 30 °C · Store below +30°C.
- solubility
- 0.01 g/l · <0.01g/l
- form
- Liquid
- color
- Clear colorless
- Water Solubility
- 0.01 g/L · < 0.01 g/L (20 ºC)
- BRN
- 1742639 · 1742639
- Henry's Law Constant
- 3.9 · 3.9×10-4 mol/(m3Pa) at 25℃, Yaws et al. (2005)
- InChI
- InChI=1S/C14H29Cl/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15/h2-14H2,1H3
- InChIKey
- RNHWYOLIEJIAMV-UHFFFAOYSA-N
- SMILES
- C(Cl)CCCCCCCCCCCCC
- CAS DataBase Reference
- 2425 · 2425-54-9(CAS DataBase Reference)
- FDA UNII
- 97 D1SF0719 · 97D1SF0719
- NIST Chemistry Reference
- 1 · Tetradecane, 1-chloro-(2425-54-9)
- EPA Substance Registry System
- 1 · Tetradecane, 1-chloro- (2425-54-9)
- UNSPSC Code
- 12352100 · 12352100
- NACRES
- 22 · NA.22
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 315 · H315-H319
- Precautionary statements
- 264 · P264-P280-P302+P352+P332+P313+P362+P364-P305+P351+P338+P337+P313
- PPE
- Eyeshields, Gloves, type ABEK (EN14387) respirator filter
- Hazard Codes
- Xi
- Risk Statements
- 36 · 36/37/38
- Safety Statements
- 24 · 24/25-36-26
- RIDADR
- 3082 · UN 3082
- WGK Germany
- 3 · 3
- TSCA
- TSCA listed
- HS Code
- 29031980 · 29031980
- Storage Class
- 10 · 10 - Combustible liquids
Safety & regulation
GHS classification
GHS Classification
Warning
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation];H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation];H335 (97.4%): 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 39 reports by companies from 2 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
Regulatory Information
Chemical: Tetradecane, 1-chloro-
Tetradecane, 1-chloro- is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of Tetradecane, 1-chloro- are required to report information about their production and use of this chemical to the EPA under the Toxic Substances Control Act (TSCA). (40 eCFR Part 711)
Tetradecane, 1-chloro-: Does not have an individual approval but may be used under an appropriate group standard
Regulatory information
Regulatory Information
Chemical: Tetradecane, 1-chloro-
Tetradecane, 1-chloro- is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of Tetradecane, 1-chloro- are required to report information about their production and use of this chemical to the EPA under the Toxic Substances Control Act (TSCA). (40 eCFR Part 711)
Tetradecane, 1-chloro-: Does not have an individual approval but may be used under an appropriate group standard
Safety data
- PPE
- Eyeshields, Gloves, type ABEK (EN14387) respirator filter
- wgk
- 3
- tsca
- TSCA listed
- ridadr
- UN 3082
- hs_code
- 29031980
- risk_code
- 36/37/38
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_code
- Xi
- safety_code
- 24/25-36-26
- Storage Class
- 10 - Combustible liquids
- Hazard statements
- H315-H319
- Precautionary statements
- P264-P280-P302+P352+P332+P313+P362+P364-P305+P351+P338+P337+P313
Chemistry & industry
Uses & manufacturing
General Manufacturing Information
All Other Basic Organic Chemical Manufacturing;Pesticide, Fertilizer, and Other Agricultural Chemical Manufacturing
Tetradecane, 1-chloro-: ACTIVE
Applications
Uses1-Chlorotetradecane is a useful synthetic intermediate. It is an intermediate used to prepare Dimethyldimyristyl ammonium chloride (D472560), a surfactant.
Uses1-Chlorotetradecane has been used:in preparation of nonionic microemulsion of pentaoxyethylene glycol dodecyl ether, water and 1-chlorotetradecaneas internal standard in determination of 3-chloropropane-1,2-diol in hydrolyzed vegetable protein by capillary gas chromatography with electrolytic conductivity detection
Uses1-Chlorotetradecane is used as a chemical intermediate.
General DescriptionPhase behavior and phase separation kinetics of ternary nonionic microemulsion system composed of pentaethylene glycol dodecyl ether, water and 1-chlorotetradecane was studied.
Preparation methods
PreparationThere are two main methods for preparing 1-Chlorotetradecane: direct chlorination and indirect chlorination. Direct chlorination involves reacting tetradecane with chlorine gas in the presence of a catalyst to produce 1-Chlorotetradecane. This method is simple to operate, but the product may contain byproducts with varying degrees of chlorination, requiring subsequent separation and purification. Indirect chlorination involves first converting tetradecane into other intermediates before subjecting it to chlorination to obtain 1-Chlorotetradecane.
Upstream & downstream products
Downstream products
Suppliers100 total
Related reactions
Compound notes
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