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89398-60-7 | 3a,7a-Methano-1H-indene-1-carboxaldehyde, hexahydro-
CAS No: 89398-60-7 Catalog No: AG003WAO MDL No:
Product Description
Catalog Number:
AG003WAO
Chemical Name:
3a,7a-Methano-1H-indene-1-carboxaldehyde, hexahydro-
CAS Number:
89398-60-7
Molecular Formula:
C11H16O
Molecular Weight:
164.2441
IUPAC Name:
tricyclo[4.3.1.01,6]decane-7-carbaldehyde
InChI:
InChI=1S/C11H16O/c12-7-9-3-6-10-4-1-2-5-11(9,10)8-10/h7,9H,1-6,8H2
InChI Key:
FVEGQEAPEBARCP-UHFFFAOYSA-N
SMILES:
O=CC1CCC23C1(CCCC3)C2
Properties
Complexity:
235
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
164.12g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
164.248g/mol
Monoisotopic Mass:
164.12g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
3
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9
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