Results for:
PubChem ID: 125468

(E)-2-methylbut-2-enoic Acid

Mass-Spectra

Compound Details

Synonymous names
TIGLIC ACID
80-59-1
Tiglinic acid
Cevadic acid
trans-2,3-Dimethylacrylic acid
2-methylbut-2-enoic acid
(E)-2-Methylbut-2-enoic acid
trans-2-Methyl-2-butenoic acid
(E)-2-Methyl-2-butenoic acid
2-Methyl-2-butenoic acid
trans-2-Methylcrotonic acid
(E)-2,3-Dimethylacrylic acid
(E)-2-Methylcrotonic acid
Crotonic acid, 2-methyl-, (E)-
2-Butenoic acid, 2-methyl-, (2E)-
tiglate
(2E)-2-methylbut-2-enoic acid
2,3-Dimethylacrylic acid, (E)-
alpha-Methylcrotonic acid
FEMA No. 3599
trans-alpha,beta-Dimethylacrylic acid
13201-46-2
2-Butenoic acid, 2-methyl-, (E)-
2-Methylcrotonic acid
NSC 44235
Tiglinsaeure
alpha-Methylcrotonic acid, (E)-
2-Methyl-2-butenoic acid, (E)-
EINECS 201-295-0
(E)-2-methyl-Crotonic acid
UNII-I5792N03HC
BRN 1236500
CHEBI:9592
AI3-36118
HSDB 7614
methyl methacrylic acid
I5792N03HC
NSC-8999
2,3-Dimethylacrylic acid
MFCD00066864
NSC-44235
2-methyl-2E-butenoic acid
trans-.alpha.,.beta.-Dimethylacrylic acid
2-methyl-(E)-2-butenoic acid
alpha,beta-dimethyl acrylic acid
E)-2-METHYLCROTONIC ACID
NSC8999
4-02-00-01552 (Beilstein Handbook Reference)
NSC44235
2-METHYLBUT-2-ENOIC ACID, (E)-
METHYL-2-BUTENOIC ACID, TRANS-2-
sabadillic acid
2-Butenoic acid,2-methyl-
Cevadate
Tiglinate
epsilon-Tiglate
E-Tiglate
Methylbutenoicacid
E-Tiglic acid
(2E)-2-Methyl-2-butenoic acid
2-methyl-Crotonate
epsilon-Tiglic acid
EINECS 236-167-3
methyl crotonic acid
methylmethacrylic acid
2,3-Dimethylacrylate
2-methyl-2-butenoate
Tiglic acid, (E)-
2-Methylbut-2-enoate
2-methyl-Crotonic acid
trans-2-Methylcrotonate
(E)-2-Methylcrotonate
2-methylbut-2-enoicacid
(E)-2-methyl-Crotonate
alpha-methyl-crotonic acid
TIGLIC ACID [MI]
trans-2,3-Dimethylacrylic acid (Tiglic acid)
bmse000727
TIGLIC ACID [HSDB]
trans-2,3-Dimethylacrylate
(E)-2,3-Dimethylacrylate
2-methyl-(E)-2-butenoate
trans-2-Methyl-2-butenoate
(E)-2-methyl-2-Butenoate
SCHEMBL15042
CHEMBL52416
(2E)-2-Methyl-2-butenoate
GTPL6499
trans-Crotonic acid, 2-methyl-
CHEBI:36432
trans-alpha,beta-Dimethylacrylate
DTXSID80883257
trans-2-methyl-but-2-enoic acid
BCP18945
(2E)-2-Methyl-2-butenoic acid #
LMFA01020030
s3789
AKOS003375681
CCG-266028
CS-W013715
HY-W012999
trans-2,3-Dimethylacrylic acid, 98%
(E)-.ALPHA.-METHYLCROTONIC ACID
NCGC00648718-02
LS-13047
CS-0356606
NS00009823
T0246
EN300-83150
C08279
D78012
EN300-370249
TRANS-2-METHYL-2-BUTENOIC ACID [FHFI]
trans-2-Methyl-2-butenoic acid, >=99%, FG
A839954
Q425475
Q27116830
F0001-2086
Z1205493556
trans-2-Methylcrotonic acid = trans-2-Methyl-2-butenoate
trans-2-Methylcrotonic acid = trans-2-Methyl-2-butenoic acid
trans-2-Methylcrotonic acid = trans-2-Methyl-2-butenoic acid = Tiglinate
alpha,beta-dimethyl acrylic acid; 2-Methyl-2-butenoic acid; (E)-2-methyl-Crotonic acid
trans-2-Methylcrotonic acid = trans-2-Methyl-2-butenoic acid = Tiglinic acid
Microorganism:

Yes

IUPAC name(E)-2-methylbut-2-enoic acid
SMILESCC=C(C)C(=O)O
InchiInChI=1S/C5H8O2/c1-3-4(2)5(6)7/h3H,1-2H3,(H,6,7)/b4-3+
FormulaC5H8O2
PubChem ID125468
Molweight100.12
LogP1
Atoms7
Bonds1
H-bond Acceptor2
H-bond Donor1
Chemical Classificationacids carboxylic acids organic acids
CHEBI-ID9592
Supernatural-IDSN0371153-02

mVOC Specific Details

Boiling Point
DegreeReference
198.5 deg C at 760 mm Hg, 95.0-96 deg C at 11.5 mm HgO'Neil, M.J. (ed.). The Merck Index - An Encyclopedia of Chemicals, Drugs, and Biologicals. Whitehouse Station, NJ: Merck and Co., Inc., 2006., p. 1621
Vapor Pressure
PressureReference
1.33X10-1 mm Hg at 25 deg CPerry RH and Green D; Perry's Chemical Handbook. 6th ed. New York, NY: McGraw Hill p. 3-61 (1984)
MS-Links
1D-NMR-Links
Massbank-Links

Species emitting the compound
KingdomSpeciesBiological FunctionOrigin/HabitatReference
EukaryotaFistulina HepaticaNAWu et al. 2005
Bacillus CereusKoilybayeva et al. 2023
Method
KingdomSpeciesGrowth MediumApplied MethodVerification
EukaryotaFistulina Hepaticano
Bacillus Cereusbacteriological agar (BA, 15 g/L), gelatin peptone (GP, 5 g/L), and meat extract (ME, 3 g/L)GC–MSno