Home Carbonyls 1,3-Benzodioxole-4-carbonyl chloride

1,3-Benzodioxole-4-carbonyl chloride

CAS No.:
66411-55-0
Catalog Number:
AG006M01
Molecular Formula:
C8H5ClO3
Molecular Weight:
184.5765
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$88
- +
5g
98%
In Stock USA
United States
$400
- +
Product Description
Catalog Number:
AG006M01
Chemical Name:
1,3-Benzodioxole-4-carbonyl chloride
CAS Number:
66411-55-0
Molecular Formula:
C8H5ClO3
Molecular Weight:
184.5765
MDL Number:
MFCD13174065
IUPAC Name:
1,3-benzodioxole-4-carbonyl chloride
InChI:
InChI=1S/C8H5ClO3/c9-8(10)5-2-1-3-6-7(5)12-4-11-6/h1-3H,4H2
InChI Key:
LVBLTFSJUMJXBI-UHFFFAOYSA-N
SMILES:
ClC(=O)c1cccc2c1OCO2
Properties
Complexity:
195  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
183.993g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
184.575g/mol
Monoisotopic Mass:
183.993g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
35.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2  
Properties