4-Chloro-1-butene
Basic information
- CAS
927-73-1- Standard SMILES
C=CCCCl- InChIKey
WKEVRZCQFQDCIR-UHFFFAOYSA-N- Molecular formula
- C4H7Cl
- Average molar mass
- 90.55 g/mol
- Monoisotopic mass
- 90.0236279
Names & identifiers
- Preferred name
- 4-Chloro-1-butene
- IUPAC
- 4-chlorobut-1-ene
- English name
- 4-CHLORO-1-BUTENE
- Molecular formula
- C4H7Cl
- Molecular weight
- 90.55
Names & synonyms
4-CHLORO-1-BUTENE927-73-11-Butene, 4-chloro-EINECS 213-160-34Chlorobut1eneDTXSID00612981Butene, 4chloroRefChem:98295DTXCID80488124-Chlorobut-1-eneMFCD000393864-chloro-1-buten
Show more names
4-Chlorobutene3-butenylchloride1-chloro-3-butene4-chloro-but-1-ene1-butene,4-chloro-3-Buten-1-ylchlorideAllylcarbinyl chloride4-Chloro-1-Butene,>97%
1-but-3-enyl chlorideSCHEMBL293691SCHEMBL1025847SCHEMBL2304430SCHEMBL4319882SCHEMBL8759177SCHEMBL9051949AKOS006274038
Database identifiers
- CAS
927-73-1- PubChem CID
- 13565
- DTXSID
DTXSID0061298- EC Number
- 213-160-3
- Nikkaji
- J88.036A
Properties
Computed structural properties
- XLogP
- 1.9
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 0
- Rotatable bonds
- 2
- Heavy atoms
- 5
- Formal charge
- 0
- Complexity
- 24.8
Experimental & physicochemical properties
Chemical ClassesOther Classes -> Halogenated Aliphatics, Unsaturated
SpringerMaterials PropertiesSchoenflies notation
Vapor Pressure66.4 [mmHg]
Physical DescriptionLiquid; [MP Biomedicals MSDS]
Physicochemical properties
- Melting point
- -96 °C · -96°C (estimate)
- Boiling point
- 73 ℃ · 73℃
- Density
- 0.896 · 0.896
- refractive index
- 1.4192 · 1.4192
- Flash point
- -12 ℃ · -12℃
- form
- clear liquid
- color
- Colorless to Light yellow
- InChI
- InChI=1S/C4H7Cl/c1-2-3-4-5/h2H,1,3-4H2
- InChIKey
- WKEVRZCQFQDCIR-UHFFFAOYSA-N
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
H225 (100%): Highly Flammable liquid and vapor [Danger Flammable liquids]
P210, P233, P240, P241, P242, P243, P264, P264+P265, P270, P280, P301+P317, P302+P352, P303+P361+P353, P305+P351+P338, P321, P330, P332+P317, P337+P317, P362+P364, P370+P378, P403+P235, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 4 reports by companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Regulatory InformationREACH registered substance: 4-chlorobut-1-ene (EC: 213-160-3)
Hazards SummaryCauses weight loss in 44-week constant feeding studies of rabbits and rats; [RTECS] May cause irritation; [MP Biomedicals MSDS] See Allyl bromide and 1-Chloro-1-propene.
Hazard Classes and CategoriesFlam. Liq. 2 (100%)
Safety data
- tsca
- TSCA listed
- rtecs
- EM4262000
- ridadr
- UN1993
- hs_code
- 2903.29.0000
- Signal word
- Danger
- Symbol(GHS)
- GHS07,GHS02
- hazard_class
- 3
- Hazard statements
- H302-H315-H319-H225
- Limited Quantities
- 1.0 L (0.3 gallon) (liquid)
- Excepted Quantities
Chemistry & industry
Uses & manufacturing
General Manufacturing Information1-Butene, 4-chloro-: ACTIVE
Upstream & downstream products
Upstream raw materials
Downstream products
Suppliers
Loading…
Open inquiries
Loading…
Related reactions
3 records
Compound notes
Loading…