1.0
2010-04-08 22:12:48 UTC
2015-07-20 23:34:57 UTC
FDB017030
Eugenyl formate
Flavouring ingredient
2-Methoxy-4-(2-propenyl)phenyl formate
4-(2-Propen-1-yl)-2-methoxyphenyl formate
4-(2-Propenyl)-2-methoxyphenyl formate
4-Allyl-2-methoxyphenol formate
4-Allyl-2-methoxyphenyl formate
Eugenol formate
Eugenyl formate
FEMA 2473
Phenol, 2-methoxy-4-(2-propenyl)-, formate
Phenol, 4-allyl-2-methoxy-, formate
Phenol, 4-allyl-2-methoxy-, formate (ester)
C11H12O3
192.2112
192.07864425
2-methoxy-4-(prop-2-en-1-yl)phenyl formate
eugenyl formate
10031-96-6
COC1=C(OC=O)C=CC(CC=C)=C1
InChI=1S/C11H12O3/c1-3-4-9-5-6-10(14-8-12)11(7-9)13-2/h3,5-8H,1,4H2,2H3
JUTKIGGQRLHTJN-UHFFFAOYSA-N
belongs to the class of organic compounds known as anisoles. These are organic compounds containing a methoxybenzene or a derivative thereof.
Anisoles
Organic compounds
Benzenoids
Phenol ethers
Anisoles
Aromatic homomonocyclic compounds
Alkyl aryl ethers
Carbonyl compounds
Carboxylic acid esters
Hydrocarbon derivatives
Methoxybenzenes
Monocarboxylic acids and derivatives
Organic oxides
Phenoxy compounds
Alkyl aryl ether
Anisole
Aromatic homomonocyclic compound
Carbonyl group
Carboxylic acid derivative
Carboxylic acid ester
Ether
Hydrocarbon derivative
Methoxybenzene
Monocarboxylic acid or derivatives
Monocyclic benzene moiety
Organic oxide
Organic oxygen compound
Organooxygen compound
Phenoxy compound
logp
2.87
logs
-2.88
solubility
2.51e-01 g/l
logp
2.47
pka_strongest_basic
-4.9
iupac
2-methoxy-4-(prop-2-en-1-yl)phenyl formate
average_mass
192.2112
mono_mass
192.07864425
smiles
COC1=C(OC=O)C=CC(CC=C)=C1
formula
C11H12O3
inchi
InChI=1S/C11H12O3/c1-3-4-9-5-6-10(14-8-12)11(7-9)13-2/h3,5-8H,1,4H2,2H3
inchikey
JUTKIGGQRLHTJN-UHFFFAOYSA-N
polar_surface_area
35.53
refractivity
53.45
polarizability
20.07
rotatable_bond_count
5
acceptor_count
2
donor_count
0
physiological_charge
0
formal_charge
0
Specdb::MsIr
7736
Specdb::MsIr
7737
Specdb::CMs
13303
Specdb::CMs
148286
Specdb::MsMs
54867
Specdb::MsMs
54868
Specdb::MsMs
54869
Specdb::MsMs
144966
Specdb::MsMs
144967
Specdb::MsMs
144968
Specdb::MsMs
2748484
Specdb::MsMs
2748485
Specdb::MsMs
2748486
Specdb::MsMs
2933910
Specdb::MsMs
2933911
Specdb::MsMs
2933912
HMDB37877
#<Reference:0x0000555674bdc458>
dry
orris
warm
woody