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130466-96-5 | Oxirane, 2-heptyl-, (2R)-
CAS No: 130466-96-5 Catalog No: AG000UG8 MDL No:
Product Description
Catalog Number:
AG000UG8
Chemical Name:
Oxirane, 2-heptyl-, (2R)-
CAS Number:
130466-96-5
Molecular Formula:
C9H18O
Molecular Weight:
142.2386
IUPAC Name:
(2R)-2-heptyloxirane
InChI:
InChI=1S/C9H18O/c1-2-3-4-5-6-7-9-8-10-9/h9H,2-8H2,1H3/t9-/m1/s1
InChI Key:
GXOYTMXAKFMIRK-SECBINFHSA-N
SMILES:
CCCCCCC[C@H]1OC1
Properties
Complexity:
80.8
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
142.136g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
142.242g/mol
Monoisotopic Mass:
142.136g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
12.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6
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