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Home > Other Heterocycles > 139399-01-2
139399-01-2 | Bicyclo[2.2.1]heptane-1-carbonyl chloride, 7,7-dimethyl-2,3-dioxo-
CAS No: 139399-01-2 Catalog No: AG001AXP MDL No:
Product Description
Catalog Number:
AG001AXP
Chemical Name:
Bicyclo[2.2.1]heptane-1-carbonyl chloride, 7,7-dimethyl-2,3-dioxo-
CAS Number:
139399-01-2
Molecular Formula:
C10H11ClO3
Molecular Weight:
214.6455
IUPAC Name:
7,7-dimethyl-2,3-dioxobicyclo[2.2.1]heptane-1-carbonyl chloride
InChI:
InChI=1S/C10H11ClO3/c1-9(2)5-3-4-10(9,8(11)14)7(13)6(5)12/h5H,3-4H2,1-2H3
InChI Key:
VSGWZEXTHLODJA-UHFFFAOYSA-N
SMILES:
O=C1C2CCC(C1=O)(C2(C)C)C(=O)Cl
Properties
Complexity:
358
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
214.04g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
214.645g/mol
Monoisotopic Mass:
214.04g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
51.2A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7
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