| CAS Number | 55183-45-4 |
| Catalog Number | AG01BEJP(AGN-PC-0WCLI4) |
| Chemical Name | 5-Hexynoyl chloride |
| IUPAC Name | hex-5-ynoyl chloride |
| InChI | InChI=1S/C6H7ClO/c1-2-3-4-5-6(7)8/h1H,3-5H2 |
| InChI Key | WZBQFNAWQPYQPM-UHFFFAOYSA-N |
| MDL Number | MFCD03424696 |
| Molecular Formula | C6H7ClO |
| Molecular Weight | 130.5722 |
| SMILES | C#CCCCC(Cl)=O |
| Synonyms | hex-5-ynoyl chloride,
5-Hexynoyl chloride,
55183-45-4,
5-Hexynoic acid chloride,
AC1MC027,
SCHEMBL1556234,
CTK1F7330,
DTXSID70374720,
WZBQFNAWQPYQPM-UHFFFAOYSA-N,
ZINC2574131,
AKOS006275827,
NE58206,
FT-0704924,
Not Available,
ZINC02574131,
CID2759284,
|
| Complexity | 120 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 130.019g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 8 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 130.571g/mol |
| Monoisotopic Mass | 130.019g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 17.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.6 |
GHS Hazard and Precautionary Statements
| Symbol: |  |
|
Hazard Class
|
8
|
|
Hazard statements
|
H314-H318
|
|
Packing Group
|
Ⅲ
|
|
Precautionary statements
|
P260-P264-P280-P301+P330+P331-P303+P361+P353-P304+P340-P305+P351+P338-P310-P321-P363-P405-P501
|
|
UN Code
|
UN 1760
|
Certificate of Analysis
Lot Number