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Home > Other Heterocycles > 2094-68-0
2094-68-0 | Bicyclo[2.2.1]heptane-1-carbonyl chloride
CAS No: 2094-68-0 Catalog No: AG002K7U MDL No:
Product Description
Catalog Number:
AG002K7U
Chemical Name:
Bicyclo[2.2.1]heptane-1-carbonyl chloride
CAS Number:
2094-68-0
Molecular Formula:
C8H11ClO
Molecular Weight:
158.6253
IUPAC Name:
bicyclo[2.2.1]heptane-1-carbonyl chloride
InChI:
InChI=1S/C8H11ClO/c9-7(10)8-3-1-6(5-8)2-4-8/h6H,1-5H2
InChI Key:
ADEWYRHNJCWZDZ-UHFFFAOYSA-N
SMILES:
ClC(=O)C12CCC(C2)CC1
Properties
Complexity:
168
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
158.05g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
158.625g/mol
Monoisotopic Mass:
158.05g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
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