Home Halogens 6-chloro-1,3-dioxaindane-5-carboxylic acid

6-chloro-1,3-dioxaindane-5-carboxylic acid

CAS No.:
2591-26-6
Catalog Number:
AG01BRMZ
Molecular Formula:
Molecular Weight:
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Product Description
Catalog Number:
AG01BRMZ
Chemical Name:
6-chloro-1,3-dioxaindane-5-carboxylic acid
CAS Number:
2591-26-6
MDL Number:
MFCD06203631
IUPAC Name:
6-chloro-1,3-benzodioxole-5-carboxylic acid
InChI:
InChI=1S/C8H5ClO4/c9-5-2-7-6(12-3-13-7)1-4(5)8(10)11/h1-2H,3H2,(H,10,11)
InChI Key:
NDFQRSMGWGHELT-UHFFFAOYSA-N
Properties
Complexity:
220  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
199.988g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
200.574g/mol
Monoisotopic Mass:
199.988g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
55.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9  
Properties