Basic information
- CAS
32541-58-5- Standard SMILES
CC(=O)CCOC(C)C- InChIKey
MEWOUXCWMNHTIZ-UHFFFAOYSA-N- Molecular formula
- C7H14O2
- Average molar mass
- 130.18 g/mol
- Monoisotopic mass
- 130.09937969
Names & identifiers
- Preferred name
- 4-Isopropoxy-2-butanone
- IUPAC
- 4-propan-2-yloxybutan-2-one
- English name
- 4-Isopropoxy-2-butanone
- Molecular formula
- C7H14O2
- Molecular weight
- 130.18
Names & synonyms
4-Isopropoxy-2-butanone32541-58-5DTXSID50337075RefChem:524312DTXCID40288163805-851-94-propan-2-yloxybutan-2-one4-ISOPROPOXYBUTAN-2-ONEMFCD000593584-(propan-2-yloxy)butan-2-oneSCHEMBL5114255MEWOUXCWMNHTIZ-UHFFFAOYSA-
Show more names
Isopropoxybutanone4-Isopropoxybutane-2-one4-Isopropoxy-2-butanone>4-ISOPROPOXY-2-BUTANONE 95+%2-Butanone, 4-(1-methylethoxy)-Methyl 2-isopropoxyethyl ketone
4-[(Propan-2-yl)oxy]butan-2-oneAKOS009158302AS-92320SY054910D91116EN300-1857092InChI=1/C7H14O2/c1-6(2)9-5-4-7(3)8/h6H,4-5H2,1-3H3
Database identifiers
- CAS
32541-58-5- PubChem CID
- 538375
- DTXSID
DTXSID50337075- EC Number
- 805-851-9
- Nikkaji
- J208.632H
Properties
Computed structural properties
- XLogP
- 0.5
- Topological polar surface area
- 26.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 4
- Heavy atoms
- 9
- Formal charge
- 0
- Complexity
- 86.9
Physicochemical properties
- Boiling point
- 75 °C · 75 °C / 35mmHg
- Density
- 0 · 0,89 g/cm3
- refractive index
- 1.407 to · 1.4070 to 1.4100
- form
- clear liquid
- color
- Colorless to Almost colorless
- Symbol(GHS)
- 2 · GHS02
- Signal word
- Warning
- Hazard statements
- 226 · H226
- Risk Statements
- 36 · 36/37/38
- Safety Statements
- 26 · 26-36/37/39
- RIDADR
- 1993 · UN 1993 3/PG III
- HazardClass
- 3 · 3
- PackingGroup
- III
- HS Code
- 2914500090 · 2914500090
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, P280, P303+P361+P353, P370+P378, P403+P235, 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%)
Safety data
- ridadr
- UN 1993 3/PG III
- hs_code
- 2914500090
- risk_code
- 36/37/38
- Signal word
- Warning
- Symbol(GHS)
- GHS02
- safety_code
- 26-36/37/39
- hazard_class
- 3
- packing_group
- III
- Hazard statements
- H226
Chemistry & industry
Suppliers19 total
梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]
Aladdin Scientific[email protected]
安耐吉化学&3A（安徽泽升科技股份有限公司）400-0056266 · [email protected]
TCI AMERICA800-4238616 · [email protected]
TOKYO CHEMICAL INDUSTRY CO., LTD.03-36680489 · [email protected]
TCI Europe320-37350700 · [email protected]
上海敏寒医药科技有限公司17612188245 · [email protected]
PT CHEM GROUP LIMITED+86-85511178; +86-85511178 · [email protected]
安庆济达生物科技有限公司0556-5881618 18956990316 · [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]
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]
Related reactions
3 records
Compound notes
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