1.0
2010-04-08 22:07:59 UTC
2025-11-18 23:08:13 UTC
FDB008240
1-Penten-3-ol
Isolated from soya (Glycine max), banana, orange juice or peel oil, raspberries, asparagus, shallot, crispbread, smoked fatty fish, scallops, roasted peanut, black and green tea (Thea sinensis) and other foods. Flavouring ingredient. 1-Penten-3-ol is found in many foods, some of which are pulses, sweet bay, blackcurrant, and kohlrabi.
α-ethylallyl alcohol
1-Ethylallyl alcohol
1-penten-3-ol (E)
1-Pentene-3-ol
Alpha-ethylallyl alcohol
Ethyl vinyl carbinol
Ethylvinylcarbinol
FEMA 3584
pent-1-en-3-ol
penten-3-ol
Vinyl ethyl carbinol
C5H10O
86.1323
86.073164942
pent-1-en-3-ol
1-penten-3-ol
616-25-1
CCC(O)C=C
InChI=1S/C5H10O/c1-3-5(6)4-2/h3,5-6H,1,4H2,2H3
VHVMXWZXFBOANQ-UHFFFAOYSA-N
belongs to the class of organic compounds known as secondary alcohols. Secondary alcohols are compounds containing a secondary alcohol functional group, with the general structure HOC(R)(R') (R,R'=alkyl, aryl).
Secondary alcohols
Organic compounds
Organic oxygen compounds
Organooxygen compounds
Alcohols and polyols
Aliphatic acyclic compounds
Hydrocarbon derivatives
Aliphatic acyclic compound
Hydrocarbon derivative
Secondary alcohol
logp
1.13
ALOGPS
logs
-0.20
ALOGPS
solubility
5.45e+01 g/l
ALOGPS
logp
1.15
ChemAxon
pka_strongest_acidic
17.46
ChemAxon
pka_strongest_basic
-1.7
ChemAxon
iupac
pent-1-en-3-ol
ChemAxon
average_mass
86.1323
ChemAxon
mono_mass
86.073164942
ChemAxon
smiles
CCC(O)C=C
ChemAxon
formula
C5H10O
ChemAxon
inchi
InChI=1S/C5H10O/c1-3-5(6)4-2/h3,5-6H,1,4H2,2H3
ChemAxon
inchikey
VHVMXWZXFBOANQ-UHFFFAOYSA-N
ChemAxon
polar_surface_area
20.23
ChemAxon
refractivity
26.37
ChemAxon
polarizability
10.18
ChemAxon
rotatable_bond_count
2
ChemAxon
acceptor_count
1
ChemAxon
donor_count
1
ChemAxon
physiological_charge
0
ChemAxon
formal_charge
0
ChemAxon
Specdb::EiMs
1564
Specdb::CMs
2754
Specdb::CMs
28648
Specdb::CMs
29021
Specdb::CMs
42547
Specdb::CMs
100883
Specdb::CMs
100884
Specdb::CMs
136891
Specdb::CMs
144625
Specdb::MsIr
4716
Specdb::MsIr
4717
Specdb::MsMs
88686
Specdb::MsMs
88687
Specdb::MsMs
88688
Specdb::MsMs
151470
Specdb::MsMs
151471
Specdb::MsMs
151472
Specdb::MsMs
2271615
Specdb::MsMs
2271616
Specdb::MsMs
2271617
Specdb::MsMs
3067424
Specdb::MsMs
3067425
Specdb::MsMs
3067426
Specdb::NmrOneD
3929
Specdb::NmrOneD
4208
Specdb::NmrOneD
19442
Specdb::NmrOneD
19443
Specdb::NmrOneD
19444
Specdb::NmrOneD
19445
Specdb::NmrOneD
19446
Specdb::NmrOneD
19447
Specdb::NmrOneD
19448
Specdb::NmrOneD
19449
Specdb::NmrOneD
19450
Specdb::NmrOneD
19451
Specdb::NmrOneD
19452
Specdb::NmrOneD
19453
Specdb::NmrOneD
19454
Specdb::NmrOneD
19455
Specdb::NmrOneD
19456
Specdb::NmrOneD
19457
Specdb::NmrOneD
19458
Specdb::NmrOneD
19459
Specdb::NmrOneD
19460
Specdb::NmrOneD
19461
HMDB31605
#<Reference:0x000055ce31a47a18>
Anatidae
Type 1
specific
Anatidae
8830
Asparagus
Type 1
specific
Asparagus officinalis
4686
Beefalo
Type 1
specific
Bos taurus X Bison bison
297284
Bison
Type 1
specific
Bison bison
9901
Black tea
Type 1
220.0
220.0
220.0
mg/100 g
Blackberry
Type 1
specific
Rubus
Blackcurrant
Type 1
specific
Ribes nigrum
78511
Buffalo
Type 1
specific
Bubalus bubalis
89462
Cattle (Beef, Veal)
Type 1
specific
Bos taurus
9913
Cauliflower
Type 1
specific
Brassica oleracea var. botrytis
3715
Cherry tomato
Type 1
specific
Solanum lycopersicum var. cerasiforme
195583
Chicken
Type 1
specific
Gallus gallus
9031
Columbidae (Dove, Pigeon)
Type 1
specific
Columbidae
8930
Corn
Type 1
specific
Zea mays
4577
0.0
0.0
0.0
mg/100 g
Deer
Type 1
specific
Cervidae
9850
Domestic goat
Type 1
specific
Capra aegagrus hircus
9925
Domestic pig
Type 1
specific
Sus scrofa domestica
9825
Elk
Type 1
specific
Cervus canadensis
1574408
Emu
Type 1
specific
Dromaius novaehollandiae
8790
European rabbit
Type 1
specific
Oryctolagus
9984
Evergreen blackberry
Type 1
specific
Rubus laciniatus
Fishes
Unknown
generic
Fruits
Unknown
generic
Garden tomato
Type 1
specific
Solanum lycopersicum
4081
Garden tomato (var.)
Type 1
specific
Solanum lycopersicum var. lycopersicum
397755
Green bean
Type 1
specific
Phaseolus vulgaris
3885
Green tea
Type 1
220.0
220.0
220.0
mg/100 g
Green vegetables
Unknown
generic
Greylag goose
Type 1
specific
Anser anser
8843
Guinea hen
Type 1
specific
Numida meleagris
8996
Herbal tea
Type 1
220.0
220.0
220.0
mg/100 g
Highbush blueberry
Type 1
specific
Vaccinium corymbosum
69266
Horse
Type 1
specific
Equus caballus
9796
Kohlrabi
Type 1
specific
Brassica oleracea var. gongylodes
109379
0.004
0.004
0.004
mg/100 g
Mallard duck
Type 1
specific
Anas platyrhynchos
8839
Milk (Cow)
Type 2
specific
0.183157
0.43
0.000837
mg/100 g
Mollusks
Unknown
generic
6447
Mountain hare
Type 1
specific
Lepus timidus
62621
Mule deer
Type 1
specific
Odocoileus
9871
Mung bean
Type 1
specific
Vigna radiata
157791
Nuts
Unknown
generic
Ostrich
Type 1
specific
Struthio camelus
8801
Pheasant
Type 1
specific
Phasianus colchicus
9054
Pomes
Unknown
generic
Pulses
Unknown
generic
Quail
Type 1
specific
Phasianidae
9005
Rabbit
Type 1
specific
Leporidae
9979
Rabbiteye blueberry
Type 1
specific
Vaccinium virgatum
Red raspberry
Type 1
specific
Rubus idaeus
32247
Red tea
Type 1
220.0
220.0
220.0
mg/100 g
Rock ptarmigan
Type 1
specific
Lagopus muta
64668
Safflower
Type 1
specific
Carthamus tinctorius
4222
0.019
0.019
0.019
mg/100 g
Sheep (Mutton, Lamb)
Type 1
specific
Ovis aries
9940
Soy bean
Type 1
specific
Glycine max
3847
Spearmint
Type 1
specific
Mentha spicata
29719
Squab
Type 1
specific
Columba
8931
Sweet bay
Type 1
specific
Laurus nobilis
85223
Taco
Type 2
specific
0.0
0.0
0.0
mg/100 g
Tea
Type 1
specific
Camellia sinensis
4442
220.0
220.0
220.0
mg/100 g
Tortilla chip
Type 2
specific
Turkey
Type 1
specific
Meleagris gallopavo
9103
Velvet duck
Type 1
specific
Melanitta fusca
371864
Watermelon
Type 1
specific
Citrullus lanatus
3654
Wild boar
Type 1
specific
Sus scrofa
9823
bitter
butter
fruity
green
horseradish
pungent
tropical
vegetable