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101916-99-8 | 2(3H)-Furanone, 5-(3-buten-1-ylidene)dihydro-, (5E)-
CAS No: 101916-99-8 Catalog No: AG0005YG MDL No:
Product Description
Catalog Number:
AG0005YG
Chemical Name:
2(3H)-Furanone, 5-(3-buten-1-ylidene)dihydro-, (5E)-
CAS Number:
101916-99-8
Molecular Formula:
C8H10O2
Molecular Weight:
138.1638
IUPAC Name:
5-but-3-enylideneoxolan-2-one
InChI:
InChI=1S/C8H10O2/c1-2-3-4-7-5-6-8(9)10-7/h2,4H,1,3,5-6H2
InChI Key:
HXJFSWBJOFJNBQ-UHFFFAOYSA-N
SMILES:
C=CC/C=C/1\CCC(=O)O1
Properties
Complexity:
180
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
138.068g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
138.166g/mol
Monoisotopic Mass:
138.068g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
1.5
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