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30834-42-5 | Spiro[5.5]undec-1-en-3-one
CAS No: 30834-42-5 Catalog No: AG0031FQ MDL No:MFCD18253449
Product Description
Catalog Number:
AG0031FQ
Chemical Name:
Spiro[5.5]undec-1-en-3-one
CAS Number:
30834-42-5
Molecular Formula:
C11H16O
Molecular Weight:
164.2441
MDL Number:
MFCD18253449
IUPAC Name:
spiro[5.5]undec-4-en-3-one
InChI:
InChI=1S/C11H16O/c12-10-4-8-11(9-5-10)6-2-1-3-7-11/h4,8H,1-3,5-7,9H2
InChI Key:
VIESIESOPRMRGG-UHFFFAOYSA-N
SMILES:
O=C1CCC2(C=C1)CCCCC2
NSC Number:
286670
Properties
Complexity:
209
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:
0
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2
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