Home Halogens 7-chloro-1,3-dioxaindan-5-ol

7-chloro-1,3-dioxaindan-5-ol

CAS No.:
1414972-62-5
Catalog Number:
AG01EMNY
Molecular Formula:
C7H5ClO3
Molecular Weight:
172.5658
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Product Description
Catalog Number:
AG01EMNY
Chemical Name:
7-chloro-1,3-dioxaindan-5-ol
CAS Number:
1414972-62-5
Molecular Formula:
C7H5ClO3
Molecular Weight:
172.5658
MDL Number:
MFCD30005511
IUPAC Name:
7-chloro-1,3-benzodioxol-5-ol
InChI:
InChI=1S/C7H5ClO3/c8-5-1-4(9)2-6-7(5)11-3-10-6/h1-2,9H,3H2
InChI Key:
UWYVTGMSRFJFKL-UHFFFAOYSA-N
SMILES:
Oc1cc(Cl)c2c(c1)OCO2
Properties
Complexity:
153  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
171.993g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
172.564g/mol
Monoisotopic Mass:
171.993g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
38.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2  
Properties