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Home > Other Heterocycles > 119124-62-8
119124-62-8 | 7-Oxabicyclo[4.1.0]heptan-1-ol, 2,2,6-trimethyl-, 1-formate
CAS No: 119124-62-8 Catalog No: AG000I8P MDL No:
Product Description
Catalog Number:
AG000I8P
Chemical Name:
7-Oxabicyclo[4.1.0]heptan-1-ol, 2,2,6-trimethyl-, 1-formate
CAS Number:
119124-62-8
Molecular Formula:
C10H16O3
Molecular Weight:
184.2322
IUPAC Name:
formic acid;2,2,6-trimethyl-7-oxabicyclo[4.1.0]heptan-1-ol
InChI:
InChI=1S/C9H16O2.CH2O2/c1-7(2)5-4-6-8(3)9(7,10)11-8;2-1-3/h10H,4-6H2,1-3H3;1H,(H,2,3)
InChI Key:
TVGCGZLEEJYODF-UHFFFAOYSA-N
SMILES:
O=COC12OC2(C)CCCC1(C)C
Properties
Complexity:
210
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
202.121g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
202.25g/mol
Monoisotopic Mass:
202.121g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
70.1A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
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