Basic information
- CAS
624-16-8- Standard SMILES
CCCCCCC(=O)CCC- InChIKey
MKJDUHZPLQYUCB-UHFFFAOYSA-N- Molecular formula
- C10H20O
- Average molar mass
- 156.26 g/mol
- Monoisotopic mass
- 156.15141526
Names & identifiers
- Preferred name
- 4-Decanone
- IUPAC
- decan-4-one
- English name
- 4-DECANONE
- Molecular formula
- C10H20O
- Molecular weight
- 156.27
Names & synonyms
4-DECANONEdecan-4-one624-16-8n-Propyl n-hexyl ketone502V1W8KD4EINECS 210-832-8UNII-502V1W8KD4MKJDUHZPLQYUCB-UHFFFAOYSA-DTXSID40211451RefChem:98687DTXCID40133942210-832-8
Show more names
4-Decanonecan-4-one4-Decanone>4-Decanone,98%decan-1-oyl chlorideN-HEXYL N-PROPYL KETONE
InChI=1/C10H20O/c1-3-5-6-7-9-10(11)8-4-2/h3-9H2,1-2H3MKJDUHZPLQYUCB-UHFFFAOYSA-NHexyl propyl ketonePropyl hexyl ketoneMFCD00009542SCHEMBL52401SCHEMBL126957SCHEMBL127588
Database identifiers
- CAS
624-16-8- PubChem CID
- 12203
- DTXSID
DTXSID40211451- UNII
- 502V1W8KD4
- EC Number
- 210-832-8
- Nikkaji
- J79.761H
Properties
Computed structural properties
- XLogP
- 3.2
- Topological polar surface area
- 17.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 7
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 97
Experimental & physicochemical properties
LipidsFatty Acyls [FA] -> Oxygenated hydrocarbons [FA12]
SolventsSolvents -> Ketones (<C12)
SpringerMaterials PropertiesDensity
Physical DescriptionClear colorless liquid; [Acros Organics MSDS]
Physicochemical properties
- Melting point
- -9 °C · -9 °C
- Boiling point
- 206 · 206-207 °C
- Density
- 0.82 · 0.82
- refractive index
- 1.423 · 1.423-1.425
- Flash point
- 71 °C · 71 °C
- storage temp.
- 2 · 2-8°C
- form
- clear liquid
- color
- Colorless to Light yellow
- LogP
- 3.2 · 3.200
- CAS DataBase Reference
- 624 · 624-16-8(CAS DataBase Reference)
- EWG's Food Scores
- 1 · 1
- FDA UNII
- 502 V1W8KD4 · 502V1W8KD4
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 227 · H227
- Precautionary statements
- 210 · P210-P280-P370+P378-P403+P235-P501
- Safety Statements
- 24 · 24/25
- HS Code
- 2914.19 · 2914.19.0000
Safety & regulation
Hazard information
Hazards SummaryMay cause irritation and CNS depression; [Acros Organics MSDS]
Toxicology
Adverse EffectsNeurotoxin - Acute solvent syndrome
Safety data
- hs_code
- 2914.19.0000
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- safety_code
- 24/25
- Hazard statements
- H227
- Precautionary statements
- P210-P280-P370+P378-P403+P235-P501
Chemistry & industry
Suppliers24 total
梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
Career Henan Chemica Co+86-0371-86658258 +86-13203830695 · [email protected]
爱斯特（成都）生物制药股份有限公司+86-28-85122536 85324413 · [email protected]
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]
武汉易泰科技有限公司上海分公司18930552037 · [email protected]
安耐吉化学&3A（安徽泽升科技股份有限公司）400-0056266 · [email protected]
玛雅试剂+86 (573) 82222445 (0)18006601000 452520369 · [email protected]
江苏艾康生物医药研发有限公司025-66113011 13913916777 · [email protected]
TCI AMERICA800-4238616 · [email protected]
九鼎化学（上海）科技有限公司4009209199 · [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029-029-81120477 17792793610 · [email protected]
上海源叶生物科技有限公司13636370518 · [email protected]
上海麦克林生化科技股份有限公司50706066 15221275939 · [email protected]
武汉克米克生物医药技术有限公司027-13163388153 13163388153 · [email protected]
山东西亚化学有限公司4009903999 13395398332 · [email protected]
上海贤鼎生物科技有限公司021-021-52271985 17721149837 · [email protected]
杭州洁汉化工有限公司+86-571-86217390; +8618058761490 · [email protected]
厦门盈融达化工有限公司+86-0592-6210733 · [email protected]
TCI Chemicals (India) Pvt. Ltd.[email protected]
Aladdin Scientific[email protected]
上海迈瑞尔生化科技有限公司18621169109 · [email protected]
山东天铭生物科技发展有限责任公司400-9019001 400-901-9001
北京百灵威科技有限公司18210857532 18210857532 · [email protected]
Related reactions
6 records
Compound notes
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