PubChem CID | 3314 |
Molecular Formula | C10H12O2 |
Structure |
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Synonyms |
eugenol
97-53-0 4-Allyl-2-methoxyphenol 4-Allylguaiacol Eugenic acid Allylguaiacol p-Eugenol Caryophyllic acid p-Allylguaiacol 2-Methoxy-4-prop-2-enylphenol 2-Methoxy-4-allylphenol Phenol, 2-methoxy-4-(2-propenyl)- Engenol 1,3,4-Eugenol 2-Methoxy-4-(2-propenyl)phenol 5-Allylguaiacol Synthetic eugenol 1-Hydroxy-2-methoxy-4-allylbenzene 4-Allylcatechol-2-methyl ether 2-Methoxy-1-hydroxy-4-allylbenzene 4-Allyl-1-hydroxy-2-methoxybenzene bioxeda 1-Hydroxy-2-methoxy-4-prop-2-enylbenzene Phenol, 4-allyl-2-methoxy- 2-methoxy-4-(prop-2-en-1-yl)phenol 2-Hydroxy-5-allylanisole FEMA No. 2467 4-Hydroxy-3-methoxy-1-allylbenzene 4-Hydroxy-3-methoxyallylbenzene 2-Methoxy-4-(2-propen-1-yl)phenol Eugenol (natural) 4-Allylcatechol 2-methyl ether NCI-C50453 1-allyl-4-hydroxy-3-methoxybenzene 1-Allyl-3-methoxy-4-hydroxybenzene Caswell No. 456BC FEMA Number 2467 2-Metoksy-4-allilofenol CCRIS 306 FA 100 CHEBI:4917 HSDB 210 NSC 209525 Caryophillic acid NSC-8895 EINECS 202-589-1 Eugenol (USP) Eugenol [USP] EPA Pesticide Chemical Code 102701 NSC-209525 UNII-3T8H1794QW BRN 1366759 DTXSID9020617 Phenol, 2-methoxy-4-(2-propen-1-yl)- AI3-00086 3T8H1794QW MFCD00008654 naturel CHEMBL42710 DTXCID90617 2-Methoxy-4-(3-propenyl)phenol 2-methoxy-4-prop-2-enyl-phenol EC 202-589-1 3-(3-methoxy-4-hydroxyphenyl)propene NCGC00091449-05 EUGENOL (IARC) EUGENOL [IARC] EUGENOL (II) EUGENOL [II] EUGENOL (MART.) EUGENOL [MART.] EUGENOL (USP-RS) EUGENOL [USP-RS] Eugenol [USAN] WLN: 1U2R DQ CO1 EUGENOL (EP MONOGRAPH) EUGENOL [EP MONOGRAPH] EUGENOL (USP MONOGRAPH) EUGENOL [USP MONOGRAPH] CAS-97-53-0 2-Metoksy-4-allilofenol [Polish] SR-05000002043 allylguaicol natural naturale oogenol phenylpropanoid redistillation Eugenolum fractionation, animal feed water white Dentek Eugenol alim ue fami qs Teething Gel ugenol, eugenic acid, clove, Isolate, US Pharmacopoeia Eugenol BP flash distillation clove oil fraction Nuby Teething Gel 12-(2-Cyanoethyl)-6,7,12,13-tetrahydro-13-methyl-5-oxo-5H-indolo[2,3-a]pyrrolo[3,4-c]carbazole; Goe 6976; 5,6,7,13-Tetrahydro-13-methyl-5-oxo-12H-indolo[2,3-a]pyrrolo[3,4-c]carbazole-12-propanenitrile; Eugenol,(S) 1-hydroxy-4-allyl-2-methoxybenzene Red Cross Toothache British Pharmacopoeia clove oil terpeneless eugenol for synthesis Eugenol1518 4-allyl-2methoxyphenol 3s0e EFEUF, EUGENOL [VANDF] EUGENOL [FHFI] EUGENOL [HSDB] Marshall Toothache Drops 4-allyl 2-methoxyphenol EUGENOL [FCC] EUGENOL [MI] Spectrum2_001264 Spectrum3_000646 Spectrum4_001783 Spectrum5_000425 EUGENOL [WHO-DD] 4-allyl-2-methoxy-Phenol bmse010053 Epitope ID:114091 Eugenol, puriss., 98% AnaDent Childrens Kanka Gel Eugenol Toothache Medication SCHEMBL20361 BSPBio_002251 KBioGR_002327 MLS000028901 SEUGE0001 BIDD:ER0696 DivK1c_000692 SPECTRUM1500296 SPBio_001228 GTPL2425 HMS502C14 KBio1_000692 KBio3_001471 Eugenol, ReagentPlus(R), 99% NSC8895 4-(2-Propenyl)-2-methoxyphenol Eugenol, natural, >=98%, FG NINDS_000692 Eugenol, >=98%, FCC, FG HMS1920O08 HMS2091F09 Pharmakon1600-01500296 2-methoxy-4-(2-propenyl)-phenol HY-N0337 Tox21_111134 Tox21_202040 Tox21_300105 BBL027721 BDBM50164168 CCG-38827 NSC209525 NSC757030 s4706 STL371304 Eugenol, tested according to Ph.Eur. AKOS000121354 Tox21_111134_1 CS-7807 DB09086 FS-2702 NSC-757030 SDCCGMLS-0066578.P001 IDI1_000692 USEPA/OPP Pesticide Code: 102701 Eugenol 1000 microg/mL in Acetonitrile NCGC00091449-01 NCGC00091449-02 NCGC00091449-03 NCGC00091449-04 NCGC00091449-06 NCGC00091449-07 NCGC00091449-08 NCGC00091449-10 NCGC00253915-01 NCGC00259589-01 AC-34149 DA-63321 Eugenol, Vetec(TM) reagent grade, 98% SMR000059114 2-METHOXY-4-(2'-PROPENYL)PHENOL SBI-0051381.P003 DB-261256 Eugenol, PESTANAL(R), analytical standard A0232 NS00003629 EN300-16622 D04117 AB00051992_02 A845719 Eugenol, primary pharmaceutical reference standard Q423357 Eugenol, certified reference material, TraceCERT(R) Q-201105 SR-05000002043-1 SR-05000002043-2 BRD-K32977963-001-01-9 BRD-K32977963-001-03-5 BRD-K32977963-001-05-0 Z56347226 EUGENOL (CONSTITUENT OF HOLY BASIL LEAF) [DSC] Eugenol, European Pharmacopoeia (EP) Reference Standard F0001-2306 2-methoxy-4-(prop-2-en-1-yl)phenol4-allyl-2-methoxyphenol EUGENOL (CONSTITUENT OF CINNAMOMUM CASSIA BARK) [DSC] EUGENOL (CONSTITUENT OF CINNAMOMUM VERUM BARK) [DSC] Eugenol, United States Pharmacopeia (USP) Reference Standard Eugenol, Pharmaceutical Secondary Standard; Certified Reference Material InChI=1/C10H12O2/c1-3-4-8-5-6-9(11)10(7-8)12-2/h3,5-7,11H,1,4H2,2H |
IUPAC Name | 2-methoxy-4-prop-2-enylphenol |
SMILES | COC1=C(C=CC(=C1)CC=C)O |
Canonical SMILES | COC1=C(C=CC(=C1)CC=C)O |
InChI | InChI=1S/C10H12O2/c1-3-4-8-5-6-9(11)10(7-8)12-2/h3,5-7,11H,1,4H2,2H3 |
InChIKey | RRAFCDWBNXTKKO-UHFFFAOYSA-N |
Molecular Weight | 164.2 g/mol |
XLogP3 | 2 |
Hydrogen Bond Donor Count | 1 |
Hydrogen Bond Acceptor Count | 2 |
Rotatable Bond Count | 3 |
Exact Mass | 164.084 |
Monoisotopic Mass | 164.084 |
Topological Polar Surface Area | 29.5 |
Heavy Atom Count | 12 |
Formal Charge | 0 |
Complexity | 145 |
Isotope Atom Count | 0 |
Defined Atom Stereocenter Count | 0 |
Undefined Atom Stereocenter Count | 0 |
Defined Bond Stereocenter Count | 0 |
Undefined Bond Stereocenter Count | 0 |
Covalently-Bonded Unit Count | 1 |
Insect | Gene Symbol | Validation | Reference |
---|---|---|---|
Tribolium castaneum | CYP4Q3 | R | |
Tribolium castaneum | CYP4Q5 | R | |
Tribolium castaneum | CYP4Q7 | R |