Basic information
- CAS
1975-78-6- Standard SMILES
CCCCCCCCCC#N- InChIKey
HBZDPWBWBJMYRY-UHFFFAOYSA-N- Molecular formula
- C10H19N
- Average molar mass
- 153.26 g/mol
- Monoisotopic mass
- 153.15174961
Names & identifiers
- Preferred name
- Decanenitrile
- IUPAC
- decanenitrile
- English name
- Decanonitrile
- Molecular formula
- C10H19N
- Molecular weight
- 153.26
Names & synonyms
DECANENITRILEDecanonitrile1975-78-6Caprinitrile1-CyanononaneDTXSID9027449NSC 60851602VQ5IVCNSC-6085EINECS 217-830-6AI3-11101DTXCID307449
Show more names
DecannitrilNitrile 10 Decanenitrile
EC 217-830-61CyanononaneRefChem:585458217-830-6n-DecanenitrileNonyl cyanideMFCD000395051-Decanenitrile
Database identifiers
- CAS
1975-78-6- PubChem CID
- 74791
- DTXSID
DTXSID9027449- ChEMBL
CHEMBL3185975- UNII
- 1602VQ5IVC
- EC Number
- 217-830-6
- Nikkaji
- J95.341E
Properties
Computed structural properties
- XLogP
- 3.7
- Topological polar surface area
- 23.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 7
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 109
Experimental & physicochemical properties
Chemical ClassesNitrogen Compounds -> Nitriles
SpringerMaterials PropertiesBoiling point
FragrancesFragrance Ingredient (Decanenitrile) -> IFRA transparency List
Boiling PointBoiling point equals 241°C
Physical DescriptionClear liquid; [MSDSonline]
Physicochemical properties
- Melting point
- -15 °C · -15 °C
- Boiling point
- 241 · 241-243 °C
- Density
- 0.81 · 0.81
- Flash point
- 241 · 241-243°C
- refractive index
- 1.43 · 1.4300
- storage temp.
- 30 °C · Store below +30°C.
- solubility
- slightly soluble in water, soluble in alcohol and oils.
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
This chemical does not meet GHS hazard criteria for 5.4% (80 of 1490) of reports.
Warning
H315 (94.3%): Causes skin irritation [Warning Skin corrosion/irritation]
P264, P273, P280, P302+P352, P321, P332+P317, P362+P364, P391, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 1490 reports by companies from 7 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Regulatory Information
Chemical: Decanenitrile
REACH registered substance: Decanenitrile (EC: 217-830-6)
Decanenitrile: Does not have an individual approval but may be used under an appropriate group standard
Other Safety InformationIMAP assessments - Decanenitrile: Environment tier I assessment
Hazards SummaryA respiratory tract irritant and possible skin sensitizer; Harmful if ingested; Will burn if preheated; [MSDSonline] See Nitriles.
Hazard Classes and CategoriesSkin Irrit. 2 (94.3%)
Toxicology
Adverse EffectsOther Poison - Chemical Asphyxiant
Safety data
- wgk
- WGK 3 highly water endangering
- tsca
- TSCA listed
Chemistry & industry
Uses & manufacturing
Use ClassificationFragrance Ingredients
General Manufacturing InformationDecanenitrile: ACTIVE
Applications
UsesDecanenitrile is a building block and a starting material in the preparation of diketones and ketoenamides. Also it has been suggested for use in perfume compositions.
Upstream & downstream products
Upstream raw materials
Downstream products
Suppliers58 total
梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
北京福源坊科技有限公司010-57903446 15869909019 · [email protected]
Hebei Zhuanglai Chemical Trading Co Ltd+86-16264648883 · [email protected]
毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]
Related reactions
4 records
Compound notes
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