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99213-88-4 | Acetaldehyde, (8-methyl-8-azabicyclo[3.2.1]oct-3-ylidene)-
CAS No: 99213-88-4 Catalog No: AG005SZW MDL No:
Product Description
Catalog Number:
AG005SZW
Chemical Name:
Acetaldehyde, (8-methyl-8-azabicyclo[3.2.1]oct-3-ylidene)-
CAS Number:
99213-88-4
Molecular Formula:
C10H15NO
Molecular Weight:
165.2322
IUPAC Name:
2-(8-methyl-8-azabicyclo[3.2.1]octan-3-ylidene)acetaldehyde
InChI:
InChI=1S/C10H15NO/c1-11-9-2-3-10(11)7-8(6-9)4-5-12/h4-5,9-10H,2-3,6-7H2,1H3
InChI Key:
DXXGPUVHUQMSPO-UHFFFAOYSA-N
SMILES:
O=CC=C1CC2CCC(C1)N2C
Properties
Complexity:
206
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
165.115g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
165.236g/mol
Monoisotopic Mass:
165.115g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
20.3A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8
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