Basic information
- CAS
111-32-0- Standard SMILES
COCCCCO- InChIKey
KOVAQMSVARJMPH-UHFFFAOYSA-N- Molecular formula
- C5H12O2
- Average molar mass
- 104.15 g/mol
- Monoisotopic mass
- 104.08372962
Names & identifiers
- Preferred name
- 1-Butanol, 4-methoxy-
- IUPAC
- 4-methoxybutan-1-ol
- English name
- 4-Methoxy-1-butanol
- Molecular formula
- C5H12O2
- Molecular weight
- 104.15
Names & synonyms
Show more names
Database identifiers
- CAS
111-32-0- PubChem CID
- 8107
- DTXSID
DTXSID50149438- UNII
- AH4W8HA8JH
- EC Number
- 203-858-6
- Nikkaji
- J49.693F
Properties
Computed structural properties
- XLogP
- 0.1
- Topological polar surface area
- 29.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 4
- Heavy atoms
- 7
- Formal charge
- 0
- Complexity
- 29
Experimental & physicochemical properties
Physicochemical properties
- Boiling point
- 66 °C · 66 °C / 7mmHg
- Density
- 0.93 · 0.93
- refractive index
- 1.419 · 1.4190-1.4330
- Flash point
- 73 ° · 73°(163°F)
- storage temp.
- Sealed in dry,Room Temperature
- form
- clear liquid
- pka
- 15.08 · 15.08±0.10(Predicted)
- color
- Colorless to Almost colorless
- Water Solubility
- Slightly soluble in water.
- CAS DataBase Reference
- 111 · 111-32-0(CAS DataBase Reference)
- EWG's Food Scores
- 1 · 1
- FDA UNII
- 4 W8HA8JH · AH4W8HA8JH
- NIST Chemistry Reference
- 1 · 1-Butanol, 4-methoxy-(111-32-0)
- Symbol(GHS)
- 2 · GHS02
- Signal word
- Warning
- Hazard statements
- 227 · H227
- Precautionary statements
- 210 · P210-P280-P370+P378-P403+P235-P501-P210e-P280a-P370+P378a-P501a
- Hazard Codes
- F
- Risk Statements
- 36 · 36/37/38-10
- Safety Statements
- 26 · 26-36/37/39-35-3/9/49-15
- RIDADR
- 1993 · UN1993
- RTECS
- 4550000 · EL4550000
- HazardClass
- 3 · 3
- PackingGroup
- III
- HS Code
- 29094990 · 29094990
Safety & regulation
GHS classification
GHS Classification
Warning
H226 (66.7%): Flammable liquid and vapor [Warning Flammable liquids];H227 (33.3%): Combustible liquid [Warning Flammable liquids];H315 (66.7%): Causes skin irritation [Warning Skin corrosion/irritation];H319 (66.7%): Causes serious eye irritation [Warning Serious eye damage/eye irritation];H335 (66.7%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]
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, P403+P233, P403+P235, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 3 reports by companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.;Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website.
Hazard information
Regulatory information
Safety data
- rtecs
- EL4550000
- ridadr
- UN1993
- hs_code
- 29094990
- risk_code
- 36/37/38-10
- Signal word
- Warning
- Symbol(GHS)
- GHS02
- hazard_code
- F
- safety_code
- 26-36/37/39-35-3/9/49-15
- hazard_class
- 3
- packing_group
- III
- Hazard statements
- H227
- Precautionary statements
- P210-P280-P370+P378-P403+P235-P501-P210e-P280a-P370+P378a-P501a
Chemistry & industry
Applications
Uses4-Methoxy-1-butanol is used as a chemicals, pharmaceutical intermediates, reagents. 4-Methoxy-1-butanol is used with n-butyl acetate to improve dissolving power, drying time, and flow.
Upstream & downstream products
Downstream products
Suppliers100 total
Related reactions
Compound notes
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