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84397-91-1 | Bicyclo[2.2.1]heptane-2-carboxaldehyde, 5-ethyl-
CAS No: 84397-91-1 Catalog No: AG004SUC MDL No:
Product Description
Catalog Number:
AG004SUC
Chemical Name:
Bicyclo[2.2.1]heptane-2-carboxaldehyde, 5-ethyl-
CAS Number:
84397-91-1
Molecular Formula:
C10H16O
Molecular Weight:
152.2334
IUPAC Name:
5-ethylbicyclo[2.2.1]heptane-2-carbaldehyde
InChI:
InChI=1S/C10H16O/c1-2-7-3-9-4-8(7)5-10(9)6-11/h6-10H,2-5H2,1H3
InChI Key:
AOGKYTGSUCFQHT-UHFFFAOYSA-N
SMILES:
CCC1CC2CC1CC2C=O
Properties
Complexity:
164
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
152.12g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
152.237g/mol
Monoisotopic Mass:
152.12g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
4
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
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