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119718-96-6 | 4,7-Methano-3aH-indene-3a-carbonyl chloride, octahydro-
CAS No: 119718-96-6 Catalog No: AG000PI1 MDL No:
Product Description
Catalog Number:
AG000PI1
Chemical Name:
4,7-Methano-3aH-indene-3a-carbonyl chloride, octahydro-
CAS Number:
119718-96-6
Molecular Formula:
C11H15ClO
Molecular Weight:
198.6892
IUPAC Name:
tricyclo[5.2.1.02,6]decane-2-carbonyl chloride
InChI:
InChI=1S/C11H15ClO/c12-10(13)11-5-1-2-9(11)7-3-4-8(11)6-7/h7-9H,1-6H2
InChI Key:
FTFDXTLPTQDVNU-UHFFFAOYSA-N
SMILES:
ClC(=O)C12CCCC2C2CC1CC2
Properties
Complexity:
263
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
198.081g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
198.69g/mol
Monoisotopic Mass:
198.081g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
4
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7
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