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Home > Other Heterocycles > 118063-57-3
118063-57-3 | Bicyclo[2.2.1]heptane-1-carbonyl chloride, 4,7,7-trimethyl-3-oxo-
CAS No: 118063-57-3 Catalog No: AG000IEA MDL No:
Product Description
Catalog Number:
AG000IEA
Chemical Name:
Bicyclo[2.2.1]heptane-1-carbonyl chloride, 4,7,7-trimethyl-3-oxo-
CAS Number:
118063-57-3
Molecular Formula:
C11H15ClO2
Molecular Weight:
214.6886
IUPAC Name:
4,7,7-trimethyl-3-oxobicyclo[2.2.1]heptane-1-carbonyl chloride
InChI:
InChI=1S/C11H15ClO2/c1-9(2)10(3)4-5-11(9,8(12)14)6-7(10)13/h4-6H2,1-3H3
InChI Key:
CLJXHQSQYSJUOH-UHFFFAOYSA-N
SMILES:
ClC(=O)C12CCC(C2(C)C)(C(=O)C1)C
Properties
Complexity:
334
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
214.076g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
214.689g/mol
Monoisotopic Mass:
214.076g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
34.1A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
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