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116003-90-8 | 2-Oxiranemethanol, 3-(5-hexen-1-yl)-
CAS No: 116003-90-8 Catalog No: AG000BD4 MDL No:
Product Description
Catalog Number:
AG000BD4
Chemical Name:
2-Oxiranemethanol, 3-(5-hexen-1-yl)-
CAS Number:
116003-90-8
Molecular Formula:
C9H16O2
Molecular Weight:
156.2221
IUPAC Name:
(3-hex-5-enyloxiran-2-yl)methanol
InChI:
InChI=1S/C9H16O2/c1-2-3-4-5-6-8-9(7-10)11-8/h2,8-10H,1,3-7H2
InChI Key:
PTKFEGVGRHWHBU-UHFFFAOYSA-N
SMILES:
C=CCCCCC1OC1CO
Properties
Complexity:
123
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
156.115g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
156.225g/mol
Monoisotopic Mass:
156.115g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
32.8A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7
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