Home Other Building Blocks 3-Chloro-1-butyne

3-Chloro-1-butyne

CAS No.:
21020-24-6
Catalog Number:
AG002KNJ
Molecular Formula:
C4H5Cl
Molecular Weight:
88.5355
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
>98.0%(GC)
1 week
United States
$370
- +
5g
>98.0%(GC)
1 week
United States
$803
- +
Product Description
Catalog Number:
AG002KNJ
Chemical Name:
3-Chloro-1-butyne
CAS Number:
21020-24-6
Molecular Formula:
C4H5Cl
Molecular Weight:
88.5355
MDL Number:
MFCD00143109
IUPAC Name:
3-chlorobut-1-yne
InChI:
InChI=1S/C4H5Cl/c1-3-4(2)5/h1,4H,2H3
InChI Key:
PZFBULOUMNPBFA-UHFFFAOYSA-N
SMILES:
CC(C#C)Cl
EC Number:
244-151-2
Properties
Complexity:
57.3  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
88.008g/mol
Formal Charge:
0
Heavy Atom Count:
5  
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
88.534g/mol
Monoisotopic Mass:
88.008g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3  
Literature
Title Journal
Smoke inhalation lung injury: an update. Eplasty 20080101
Properties