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Allyl2-Oxocyclohexanecarboxylate

CAS No.:
5453-93-0
Catalog Number:
AG01DES4
Molecular Formula:
Molecular Weight:
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Product Description
Catalog Number:
AG01DES4
Chemical Name:
Allyl2-Oxocyclohexanecarboxylate
CAS Number:
5453-93-0
MDL Number:
MFCD31619526
IUPAC Name:
prop-2-enyl 2-oxocyclohexane-1-carboxylate
InChI:
InChI=1S/C10H14O3/c1-2-7-13-10(12)8-5-3-4-6-9(8)11/h2,8H,1,3-7H2
InChI Key:
MDTZVBVAVFIMBP-UHFFFAOYSA-N
NSC Number:
18912
Properties
Complexity:
220  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
182.094g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
182.219g/mol
Monoisotopic Mass:
182.094g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
43.4A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7  
Properties