Basic information
- CAS
112-13-0- Standard SMILES
CCCCCCCCCC(=O)Cl- InChIKey
IPIVAXLHTVNRBS-UHFFFAOYSA-N- Molecular formula
- C10H19ClO
- Average molar mass
- 190.71 g/mol
- Monoisotopic mass
- 190.11244291
Names & identifiers
- Preferred name
- Decanoyl chloride
- IUPAC
- decanoyl chloride
- English name
- Decanoyl chloride
- Molecular formula
- C10H19ClO
- Molecular weight
- 190.71
Names & synonyms
Decanoyl chloride112-13-0decanoylchlorideCapric acid chloriden-Decanoyl chloridedecanoic acid chlorideMFCD00000771FJ16IN0UIMCaprinoyl chlorideEINECS 203-938-0Capric Acid Chloride; Capric Chloride; Caprinoyl Chloride; Decanoic Acid Chloride; n-Decanoyl Chloridecaprinic acid chloride
Show more names
DecanoyLN-CAPROYL CHLORIDECAPRIC CHLORIDECAPRYL CHLORIDECaprylic chlorideN-HEXANOYL CHLORIDE
n-decanoic acid chlorideDecanoyl chloride, 98%UNII-FJ16IN0UIMEC 203-938-0SCHEMBL234531orb1737499DTXSID4059413SBB060015
Database identifiers
- CAS
112-13-0- PubChem CID
- 66982
- DTXSID
DTXSID4059413- UNII
- FJ16IN0UIM
- EC Number
- 203-938-0
- Nikkaji
- J79.449J
Properties
Computed structural properties
- XLogP
- 5.1
- Topological polar surface area
- 17.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 8
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 112
Experimental & physicochemical properties
Chemical ClassesToxic Gases & Vapors -> Acid Halides
SpringerMaterials PropertiesOptical coefficient
Physical DescriptionClear light yellow liquid; [Sigma-Aldrich MSDS]
Physicochemical properties
- Melting point
- -87 °C · -87 °C
- Boiling point
- 94 · 94-96 °C/5 mmHg (lit.)
- Density
- 0.919 g/mL · 0.919 g/mL at 25 °C (lit.)
- vapor density
- 6.57 · 6.57 (vs air)
- refractive index
- 20 · n20/D 1.441(lit.)
- Flash point
- 223 °F · 223 °F
- storage temp.
- 30 °C · Store below +30°C.
- form
- Powder
- color
- White to yellow-beige to brown
- Water Solubility
- 100 mg/L · 100 mg/L (20 ºC)
- Sensitive
- Moisture Sensitive
- BRN
- 507055 · 507055
- InChI
- 1S/C10H19ClO/c1-2-3-4-5-6-7-8-9-10(11)12/h2-9H2,1H3
- InChIKey
- IPIVAXLHTVNRBS-UHFFFAOYSA-N
- SMILES
- CCCCCCCCCC(Cl)=O
- LogP
- 4.322 · 4.322 (est)
- CAS DataBase Reference
- 112 · 112-13-0(CAS DataBase Reference)
- EWG's Food Scores
- 1 · 1
- FDA UNII
- 16 IN0UIM · FJ16IN0UIM
- NIST Chemistry Reference
- Decanoyl chloride(112-13-0)
- EPA Substance Registry System
- Decanoyl chloride (112-13-0)
- UNSPSC Code
- 12352100 · 12352100
- NACRES
- 22 · NA.22
- Symbol(GHS)
- 5 · GHS05
- Signal word
- Danger
- Hazard statements
- 314 · H314
- Precautionary statements
- 280 · P280-P303+P361+P353-P304+P340+P310-P305+P351+P338-P363-P405
- PPE
- Faceshields, Gloves, Goggles, type ABEK (EN14387) respirator filter
- Hazard Codes
- C
- Risk Statements
- 34 · 34-37-29-20/22
- Safety Statements
- 26 · 26-36/37/39-45-8
- RIDADR
- 3265 · UN 3265 8/PG 2
- WGK Germany
- 3 · 3
- F
- 10 · 10-21
- TSCA
- TSCA listed
- HazardClass
- 8 · 8
- PackingGroup
- II
- HS Code
- 29159080 · 29159080
- Storage Class
- 8 A · 8A - Combustible corrosive hazardous materials
- Hazard Classifications
- 1 Skin · Eye Dam. 1Skin Corr. 1B
- REACH Registrations
- Active
Safety & regulation
GHS classification
GHS Classification
This chemical does not meet GHS hazard criteria for 0.6% (1 of 170) of reports.
Danger
H290 (70.6%): May be corrosive to metals [Warning Corrosive to Metals]
P234, P260, P261, P264, P264+P265, P270, P271, P272, P273, P280, P284, P301+P317, P301+P330+P331, P302+P352, P302+P361+P354, P304+P340, P305+P354+P338, P316, P317, P320, P321, P330, P333+P317, P362+P364, P363, P390, P403+P233, P405, P406, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 170 reports by companies from 12 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Regulatory Information
Chemical: Decanoyl chloride
Status: Active Update: 11-05-2019 https://echa.europa.eu/registration-dossier/-/registered-dossier/5891
Decanoyl chloride: Does not have an individual approval but may be used under an appropriate group standard
Other Safety InformationIMAP assessments - Decanoyl chloride: Human health tier I assessment
Hazards SummaryReacts violently with water; Causes burns and lachrymation; Inhalation may cause corrosive injuries to upper respiratory tract and lungs; [Sigma-Aldrich MSDS]
Hazard Classes and CategoriesMet. Corr. 1 (70.6%)
Toxicology
Adverse EffectsDermatotoxin - Skin burns.
Safety data
- F
- 10-21
- PPE
- Faceshields, Gloves, Goggles, type ABEK (EN14387) respirator filter
- wgk
- 3
- tsca
- TSCA listed
- ridadr
- UN 3265 8/PG 2
- hs_code
- 29159080
- risk_code
- 34-37-29-20/22
- Signal word
- Danger
- Symbol(GHS)
- GHS05
- hazard_code
- C
- safety_code
- 26-36/37/39-45-8
- hazard_class
- 8
- Storage Class
- 8A - Combustible corrosive hazardous materials
- packing_group
- II
- Hazard statements
- H314
- REACH Registrations
- Active
- Hazard Classifications
- Eye Dam. 1Skin Corr. 1B
- Precautionary statements
- P280-P303+P361+P353-P304+P340+P310-P305+P351+P338-P363-P405
Chemistry & industry
Uses & manufacturing
UsesUsed to make fine chemicals; [ExPub: ECHA REACH Registrations]
General Manufacturing InformationDecanoyl chloride: ACTIVE
Applications
UsesDecanoyl chloride is used in the synthesis of oligomers composed of alternating 2,6-diaminopyridine and 2,6-pyridinedicarbonyl units. It enhances the activity of proleather from Bacillus sp. during the synthesis of poly(lactic acid) in organic solvents.
General DescriptionDecanoyl chloride enhances the activity of proleather from Bacillus sp. during the synthesis of poly(lactic acid) in organic solvents.
Upstream & downstream products
Upstream raw materials
Downstream products
Suppliers100 total
国药集团化学试剂有限公司86-21-63210123 · [email protected]
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TCI Europe320-37350700 · [email protected]
上海贤鼎生物科技有限公司4009209199 · [email protected]
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Related reactions
457 records
Compound notes
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