3-Ethyl-5-hexen-3-ol
Basic information
- CAS
1907-46-6- Standard SMILES
C=CCC(O)(CC)CC- InChIKey
ZNPHYMBSDNDCCM-UHFFFAOYSA-N- Molecular formula
- C8H16O
- Average molar mass
- 128.21 g/mol
- Monoisotopic mass
- 128.12011513
Names & identifiers
- Preferred name
- 3-Ethyl-5-hexen-3-ol
- IUPAC
- 3-ethylhex-5-en-3-ol
- English name
- 3-Ethyl-5-hexen-3-ol
- Molecular formula
- C8H16O
- Molecular weight
- 128.21
Names & synonyms
3-Ethyl-5-hexen-3-ol1907-46-6DTXSID10172565NSC 24660RefChem:501412DTXCID9095056654-782-93-ethylhex-5-en-3-ol5-Hexen-3-ol, 3-ethyl-MFCD00021834NSC24660SCHEMBL5152707
Show more names
allyl diethyl carbinol3-ethyl-5-hexylene-3-ol
SCHEMBL10612995ZNPHYMBSDNDCCM-UHFFFAOYSA-NSC-24660AKOS037645159AS-57822CS-0449408G89985F771791
Database identifiers
- CAS
1907-46-6- PubChem CID
- 137255
- DTXSID
DTXSID10172565- EC Number
- 654-782-9
- Nikkaji
- J371.811E
Properties
Computed structural properties
- XLogP
- 2.3
- Topological polar surface area
- 20.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 4
- Heavy atoms
- 9
- Formal charge
- 0
- Complexity
- 82.6
Physicochemical properties
- Symbol(GHS)
- 7 · GHS07,GHS05
- Signal word
- Danger
- Hazard statements
- 318 · H318-H335-H315
- Precautionary statements
- 280 · P280-P305+P351+P338-P310-P264-P280-P302+P352-P321-P332+P313-P362
- Safety Statements
- 23 · 23-24/25
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
Danger
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P354+P338, P317, P319, P321, P332+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 38 reports by companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Hazard Classes and CategoriesSkin Irrit. 2 (100%)
Safety data
- Signal word
- Danger
- Symbol(GHS)
- GHS07,GHS05
- safety_code
- 23-24/25
- Hazard statements
- H318-H335-H315
- Precautionary statements
- P280-P305+P351+P338-P310-P264-P280-P302+P352-P321-P332+P313-P362
Suppliers
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Related reactions
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Compound notes
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