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Home > Other Heterocycles > 88982-09-6
88982-09-6 | Spiro[2.5]oct-4-ene, 4-ethynyl-5-methyl-
CAS No: 88982-09-6 Catalog No: AG0045K5 MDL No:
Product Description
Catalog Number:
AG0045K5
Chemical Name:
Spiro[2.5]oct-4-ene, 4-ethynyl-5-methyl-
CAS Number:
88982-09-6
Molecular Formula:
C11H14
Molecular Weight:
146.2289
IUPAC Name:
8-ethynyl-7-methylspiro[2.5]oct-7-ene
InChI:
InChI=1S/C11H14/c1-3-10-9(2)5-4-6-11(10)7-8-11/h1H,4-8H2,2H3
InChI Key:
VYLNUOXNMPWATM-UHFFFAOYSA-N
SMILES:
C#CC1=C(C)CCCC21CC2
Properties
Complexity:
255
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
146.11g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
146.233g/mol
Monoisotopic Mass:
146.11g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8
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