Home Other Building Blocks methyl 2-{bicyclo[2.2.1]heptan-2-yl}acetate

methyl 2-{bicyclo[2.2.1]heptan-2-yl}acetate

CAS No.:
54441-24-6
Catalog Number:
AG019XCB
Molecular Formula:
C10H16O2
Molecular Weight:
168.2328
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Product Description
Catalog Number:
AG019XCB
Chemical Name:
methyl 2-{bicyclo[2.2.1]heptan-2-yl}acetate
CAS Number:
54441-24-6
Molecular Formula:
C10H16O2
Molecular Weight:
168.2328
MDL Number:
MFCD13593679
IUPAC Name:
methyl 2-(2-bicyclo[2.2.1]heptanyl)acetate
InChI:
InChI=1S/C10H16O2/c1-12-10(11)6-9-5-7-2-3-8(9)4-7/h7-9H,2-6H2,1H3
InChI Key:
VZGCCIGVKNJKQR-UHFFFAOYSA-N
SMILES:
COC(=O)CC1CC2CC1CC2
Properties
Complexity:
188  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
168.115g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
168.236g/mol
Monoisotopic Mass:
168.115g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
3  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5  
Properties