4-Hydroxy-6-dodecenoic acid lactone, (6Z)-

PubChem CID: 5352428

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Compound Synonyms	18679-18-0, (Z)-4-Hydroxy-6-dodecenoic acid lactone, (Z)-Dihydro-5-(2-octenyl)furan-2(3H)-one, (Z)-6-Dodecen-4-olide, CIS-4-HYDROXYDODEC-6-ENOIC ACID LACTONE, gamma-Dodecen-6-lactone, cis-6-Dodecen-4-olide, FEMA No. 3780, (Z)-dairy lactone, 2(3H)-Furanone, dihydro-5-(2-octenyl)-, (Z)-, 6-Dodecen-4-olide, cis-, 5-[(Z)-oct-2-enyl]oxolan-2-one, O8B631XC2S, 1,4-Dodec-6-enolactone, cis-, 5-[(2Z)-oct-2-en-1-yl]oxolan-2-one, EINECS 242-497-9, (Z)-Dodec-6-en-4-olide, cis-4-Hydroxy-6-dodecenoic acid lactone, 4-Hydroxy-6-dodecenoic acid lactone, cis-, 2(3H)-Furanone, dihydro-5-(2Z)-2-octenyl-, Dihydro-5-(2-octenyl)-2(3H)-furanone, (Z)-, 2(3H)-Furanone, dihydro-5-(2Z)-2-octen-1-yl-, 5-[(2Z)-2-Octenyl]dihydro-2(3H)-furanone, 4-HYDROXY-6-DODECENOIC ACID LACTONE, (6Z)-, 4-HYDROXY-6-DODECENOIC ACID, LACTONE [FHFI], 5-((2Z)-oct-2-en-1-yl)oxolan-2-one, UNII-O8B631XC2S, (Z)-6-dodeceno-.gamma.-lactone, Dodeca-6-en-1,4-lactone, cis-1,4-Dodec-6-enolactone, SCHEMBL309361, .gamma.-6-(Z)-Dodecenolactone, .gamma.-Dodec-cis-6-enolactone, cis-.gamma.-Dodec-6-enolactone, (Z)-6-Dodecen-.gamma.-lactone, 6-(Z)-Dodecen-.gamma.-lactone, CHEBI:172053, DTXSID601016535, (Z)-6-Dodecenyl-.gamma.-lactone, (+,-)-(Z)-6-Dodecen-4-olide, LMFA07040067, laquo gammaRaquo -6-(Z)-dodecenolactone, laquo gammaRaquo -dodec-cis-6-enolactone, (Z)-6-Dodecen-laquo gammaRaquo -lactone, 6-(Z)-Dodecen-laquo gammaRaquo -lactone, cis-Laquo gammaRaquo -Dodec-6-enolactone, (6Z)-4-hydroxy-6-dodecenoic acid lactone, (Z)-6-dodeceno-laquo gammaRaquo -lactone, (Z)-6-dodecenyl-laquo gammaRaquo -lactone, NS00052592, (Z)-Dihydro-5-(2-octenyl)-2(3H)-furanone, 4-HYDROXY-6-DODECENOIC ACID, LACTONE, Dihydro-5-(2-octenyl)-(Z)-2(3H)-Furanone, Dihydro-5-(2Z)-2-octen-1-yl-2(3H)-furanone, Q27285474
Ghose Rule	True
Classyfire Kingdom	Organic compounds
Topological Polar Surface Area	26.3
Hydrogen Bond Donor Count	0.0
Pfizer 3 75 Rule	False
Scaffold Graph Level	CC1CCCC1
Np Classifier Class	Lactones
Deep Smiles	CCCCC/C=CCCCCC=O)O5
Heavy Atom Count	14.0
Classyfire Class	Lactones
Scaffold Graph Node Level	OC1CCCO1
Classyfire Subclass	Gamma butyrolactones
Isotope Atom Count	0.0
Molecular Complexity	196.0
Database Name	cmaup_ingredients;hmdb_chem_all;imppat_phytochem;npass_chem_all;pubchem
Defined Atom Stereocenter Count	0.0
Iupac Name	5-[(Z)-oct-2-enyl]oxolan-2-one
Prediction Hob	1.0
Class	Lactones
Veber Rule	True
Classyfire Superclass	Organoheterocyclic compounds
Xlogp	3.6
Superclass	Organoheterocyclic compounds
Subclass	Gamma butyrolactones
Gsk 4 400 Rule	True
Molecular Formula	C12H20O2
Scaffold Graph Node Bond Level	O=C1CCCO1
Prediction Swissadme	1.0
Inchi Key	QFXOXDSHNXAFEY-SREVYHEPSA-N
Silicos It Class	Soluble
Fcsp3	0.75
Logs	-3.553
Rotatable Bond Count	6.0
Logd	2.8
Synonyms	(Z)-4-Hydroxy-6-dodecenoate lactone, (+,-)-(Z)-6-Dodecen-4-olide, (Z)-6-Dodecen-4-olide, (Z)-6-Dodecen-laquo gammaraquo -lactone, (Z)-6-Dodeceno-laquo gammaraquo -lactone, (Z)-6-Dodecenyl-laquo gammaraquo -lactone, (Z)-Dihydro-5-(2-octenyl)-2(3H)-furanone, (Z)-Dihydro-5-(2-octenyl)furan-2(3H)-one, (Z)-Dodec-6-en-4-olide, 5-[(2Z)-2-Octenyl]dihydro-2(3H)-furanone, 6-(Z)-Dodecen-laquo gammaraquo -lactone, cis-1,4-Dodec-6-enolactone, cis-4-Hydroxy-6-dodecenoic acid lactone, cis-4-Hydroxydodec-6-enoic acid lactone, cis-6-Dodecen-4-olide, cis-Laquo gammaraquo -dodec-6-enolactone, D-Glucono-1,4-lactone, Dihydro-5-(2-octenyl)-(Z)-2(3H)-furanone, gamma-Dodecen-6-lactone, Laquo gammaraquo -6-(Z)-dodecenolactone, Laquo gammaraquo -dodec-cis-6-enolactone, (z) 6-dodecen-4-olide, (z)-6-dodecen-4-olide, (z)6-dodecen-4-olide
Esol Class	Soluble
Functional Groups	C/C=CC, COC(C)=O
Compound Name	4-Hydroxy-6-dodecenoic acid lactone, (6Z)-
Kingdom	Organic compounds
Prediction Hob Swissadme	1.0
Exact Mass	196.146
Formal Charge	0.0
Monoisotopic Mass	196.146
Hydrogen Bond Acceptor Count	2.0
Molecular Weight	196.29
Gi Absorption	True
Covalent Unit Count	1.0
Total Atom Stereocenter Count	1.0
Total Bond Stereocenter Count	1.0
Molecular Framework	Aliphatic heteromonocyclic compounds
Lipinski Rule Of 5	True
Esol	-2.954198
Inchi	InChI=1S/C12H20O2/c1-2-3-4-5-6-7-8-11-9-10-12(13)14-11/h6-7,11H,2-5,8-10H2,1H3/b7-6-
Smiles	CCCCC/C=C\CC1CCC(=O)O1
Nring	1.0
Np Classifier Biosynthetic Pathway	Fatty acids
Defined Bond Stereocenter Count	1.0
Egan Rule	True
Taxonomy Direct Parent	Gamma butyrolactones
Np Classifier Superclass	Fatty esters

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4-Hydroxy-6-dodecenoic acid lactone, (6Z)-

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