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Home > Other Heterocycles > 2060061-35-8
2060061-35-8 | 4-ethyl-1-phenyl-7-oxabicyclo[4.1.0]heptane
CAS No: 2060061-35-8 Catalog No: AG01BQD7 MDL No:MFCD30501299
Product Description
Catalog Number:
AG01BQD7
Chemical Name:
4-ethyl-1-phenyl-7-oxabicyclo[4.1.0]heptane
CAS Number:
2060061-35-8
Molecular Formula:
C14H18O
Molecular Weight:
202.2921
MDL Number:
MFCD30501299
IUPAC Name:
4-ethyl-1-phenyl-7-oxabicyclo[4.1.0]heptane
InChI:
InChI=1S/C14H18O/c1-2-11-8-9-14(13(10-11)15-14)12-6-4-3-5-7-12/h3-7,11,13H,2,8-10H2,1H3
InChI Key:
WKPOATAQYLTBJF-UHFFFAOYSA-N
SMILES:
CCC1CCC2(C(C1)O2)c1ccccc1
Properties
Complexity:
232
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
202.136g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
202.297g/mol
Monoisotopic Mass:
202.136g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
12.5A^2
Undefined Atom Stereocenter Count:
3
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5
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