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Home > Other Heterocycles > 114421-39-5
114421-39-5 | 7-Oxabicyclo[4.1.0]heptane, 1-methyl-3-(1-methylethenyl)-
CAS No: 114421-39-5 Catalog No: AG000BBB MDL No:
Product Description
Catalog Number:
AG000BBB
Chemical Name:
7-Oxabicyclo[4.1.0]heptane, 1-methyl-3-(1-methylethenyl)-
CAS Number:
114421-39-5
Molecular Formula:
C10H16O
Molecular Weight:
152.2334
IUPAC Name:
1-methyl-3-prop-1-en-2-yl-7-oxabicyclo[4.1.0]heptane
InChI:
InChI=1S/C10H16O/c1-7(2)8-4-5-9-10(3,6-8)11-9/h8-9H,1,4-6H2,2-3H3
InChI Key:
CENTVGAYZSECSB-UHFFFAOYSA-N
SMILES:
CC(=C)C1CCC2C(C1)(C)O2
Properties
Complexity:
197
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
152.12g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
152.237g/mol
Monoisotopic Mass:
152.12g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
12.5A^2
Undefined Atom Stereocenter Count:
3
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
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