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Home > Other Heterocycles > 7583-74-6
7583-74-6 | 1-TERT-BUTYL-7-OXA-BICYCLO[4.1.0]HEPTANE
CAS No: 7583-74-6 Catalog No: AG005I3N MDL No:
Product Description
Catalog Number:
AG005I3N
Chemical Name:
1-TERT-BUTYL-7-OXA-BICYCLO[4.1.0]HEPTANE
CAS Number:
7583-74-6
Molecular Formula:
C10H18O
Molecular Weight:
154.2493
IUPAC Name:
1-tert-butyl-7-oxabicyclo[4.1.0]heptane
InChI:
InChI=1S/C10H18O/c1-9(2,3)10-7-5-4-6-8(10)11-10/h8H,4-7H2,1-3H3
InChI Key:
YMFPKAVXZRTGRZ-UHFFFAOYSA-N
SMILES:
CC(C12CCCCC2O1)(C)C
Properties
Complexity:
168
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
154.136g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
154.253g/mol
Monoisotopic Mass:
154.136g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
12.5A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7
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