Basic information
- CAS
764-59-0- Standard SMILES
C=CCCCC=O- InChIKey
USLRUYZDOLMIRJ-UHFFFAOYSA-N- Molecular formula
- C6H10O
- Average molar mass
- 98.14 g/mol
- Monoisotopic mass
- 98.07316494
Overview
5-Hexenal is a monounsaturated fatty aldehyde.
Names & identifiers
- Preferred name
- 5-Hexenal
- IUPAC
- hex-5-enal
- English name
- hex-5-enal
- Molecular formula
- C6H10O
- Molecular weight
- 98.14
Names & synonyms
5-HexenalHex-5-enalEINECS 212-127-0DTXSID30227228RefChem:102713DTXCID30149719212-127-0InChI=1/C6H10O/c1-2-3-4-5-6-7/h2,6H,1,3-5HUSLRUYZDOLMIRJ-UHFFFAOYSA-N764-59-0LMFA06000005SCHEMBL191527
Show more names
Hex-5-en-1-al
SCHEMBL193970SCHEMBL626998SCHEMBL11429064SCHEMBL17581065CHEBI:165520AKOS013638434AT35286CS-0103260
Database identifiers
- CAS
764-59-0- PubChem CID
- 69817
- DTXSID
DTXSID30227228- ChEBI
CHEBI:165520- EC Number
- 212-127-0
- Nikkaji
- J129.203J
Properties
Computed structural properties
- XLogP
- 1.1
- Topological polar surface area
- 17.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 4
- Heavy atoms
- 7
- Formal charge
- 0
- Complexity
- 57.2
Experimental & physicochemical properties
LipidsFatty Acyls [FA] -> Fatty aldehydes [FA06]
Physicochemical properties
- Boiling point
- 128 ℃ · 128℃
- Density
- 0.817 · 0.817
- Flash point
- 19 ℃ · 19℃
- LogP
- 1.494 · 1.494 (est)
- Symbol(GHS)
- 2 · GHS02,GHS07
- Signal word
- Danger
- Hazard statements
- 225 · H225-H335-H315-H319
- Precautionary statements
- 210 · P210-P233-P240-P241-P242-P243-P280-P303+P361+P353-P370+P378-P403+P235-P501-P264-P280-P302+P352-P321-P332+P313-P362-P264-P280-P305+P351+P338-P337+P313P
Safety & regulation
GHS classification
GHS Classification
Danger
H225 (100%): Highly Flammable liquid and vapor [Danger Flammable liquids]
P210, P233, P240, P241, P242, P243, P261, P264, P264+P265, P271, P280, P302+P352, P303+P361+P353, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P370+P378, P403+P233, P403+P235, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 2 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Hazard Classes and CategoriesFlam. Liq. 2 (100%)
Safety data
- Signal word
- Danger
- Symbol(GHS)
- GHS02,GHS07
- Hazard statements
- H225-H335-H315-H319
- Precautionary statements
- P210-P233-P240-P241-P242-P243-P280-P303+P361+P353-P370+P378-P403+P235-P501-P264-P280-P302+P352-P321-P332+P313-P362-P264-P280-P305+P351+P338-P337+P313P
Chemistry & industry
Upstream & downstream products
Upstream raw materials
Downstream products
Suppliers5 total
Hangzhou Sage Chemical Co., Ltd.+86057186818502 13588463833 · [email protected]
上海相辉医药科技有限公司13761987713; 13761987713 · [email protected]
台州川旭医药科技有限公司[email protected] · [email protected]
常州合晶化工有限公司85528066 13775048983 · [email protected]
陕西缔都医药化工有限公司029-029-029-81148696 18161915376 · [email protected]
Additional notes
DefinitionChEBI: 5-Hexenal is a fatty aldehyde.
Related reactions
7 records
Compound notes
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