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Home > Other Heterocycles > 115913-31-0
115913-31-0 | Bicyclo[1.1.1]pentane-1,3-dicarbonyl dichloride
CAS No: 115913-31-0 Catalog No: AG000H3L MDL No:
Product Description
Catalog Number:
AG000H3L
Chemical Name:
Bicyclo[1.1.1]pentane-1,3-dicarbonyl dichloride
CAS Number:
115913-31-0
Molecular Formula:
C7H6Cl2O2
Molecular Weight:
193.0273
IUPAC Name:
bicyclo[1.1.1]pentane-1,3-dicarbonyl chloride
InChI:
InChI=1S/C7H6Cl2O2/c8-4(10)6-1-7(2-6,3-6)5(9)11/h1-3H2
InChI Key:
UJCYQVOGBMCBSI-UHFFFAOYSA-N
SMILES:
ClC(=O)C12CC(C1)(C2)C(=O)Cl
Properties
Complexity:
207
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
191.974g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
193.023g/mol
Monoisotopic Mass:
191.974g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
34.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5
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