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155682-86-3 | 2(3H)-Furanone, 5-(3Z)-3-hexen-1-yldihydro-, (5R)-
CAS No: 155682-86-3 Catalog No: AG001O42 MDL No:
Product Description
Catalog Number:
AG001O42
Chemical Name:
2(3H)-Furanone, 5-(3Z)-3-hexen-1-yldihydro-, (5R)-
CAS Number:
155682-86-3
Molecular Formula:
C10H16O2
Molecular Weight:
168.2328
IUPAC Name:
(5R)-5-[(Z)-hex-3-enyl]oxolan-2-one
InChI:
InChI=1S/C10H16O2/c1-2-3-4-5-6-9-7-8-10(11)12-9/h3-4,9H,2,5-8H2,1H3/b4-3-/t9-/m1/s1
InChI Key:
NKNGVPNCSFZRSM-ZBJFTSOASA-N
SMILES:
CC/C=C\CC[C@@H]1CCC(=O)O1
UNII:
X12NB2ST6R
Properties
Complexity:
173
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
1
Exact Mass:
168.115g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
168.236g/mol
Monoisotopic Mass:
168.115g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
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