Basic information
- CAS
2747-48-0- Standard SMILES
CC/C(C)=C/CO- InChIKey
QFXSWGXWZXSGLC-GQCTYLIASA-N- Molecular formula
- C6H12O
- Average molar mass
- 100.16 g/mol
- Monoisotopic mass
- 100.088815
Overview
RN given refers to cpd without isomeric designation
Names & identifiers
- Preferred name
- 3-Methyl-2-penten-1-ol
- IUPAC
- (E)-3-methylpent-2-en-1-ol
Names & synonyms
3-Methyl-2-penten-1-ol2747-48-0(E)-3-Methyl-2-penten-1-olRefChem:9473930801-95-7(E)-3-methylpent-2-en-1-ol(2E)-3-METHYLPENT-2-EN-1-OL2-Penten-1-ol, 3-methyl-, (2E)-30804-75-2(2E)-3-Methyl-2-penten-1-ol2-Penten-1-ol, 3-methyl-, (2Z)-starbld0042002
Show more names
SCHEMBL709737SCHEMBL7571152-Penten-1-ol, 3-methyl-SCHEMBL3003042trans-3-methylpent-3-en-5-olTrans-3-methylpent-3-ene-5-ol(2E)-3-Methyl-2-penten-1-ol #EN300-141099
Database identifiers
- CAS
2747-48-0- PubChem CID
- 5366209
- EC Number
- 850-516-2
Properties
Computed structural properties
- XLogP
- 1.5
- Topological polar surface area
- 20.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 2
- Heavy atoms
- 7
- Formal charge
- 0
- Complexity
- 64.6
Experimental & physicochemical properties
SpringerMaterials PropertiesDensity
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
Warning
H226 (100%): Flammable liquid and vapor [Warning 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)
The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesFlam. Liq. 3 (100%)
Related reactions
1 records
Compound notes
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