Tetrahydro-2-methyl-3-furanthiol

HCID 62128CAS 57124-87-5

Completing data — usually done within a minute

Substructure search Find similar structures

Basic information

Standard SMILES: CC1OCCC1S
InChIKey: DBPHPBLAKVZXOY-UHFFFAOYSA-N
Molecular formula: C5H10OS
Average molar mass: 118.201 g/mol
Monoisotopic mass: 118.04523594

Names & identifiers

Preferred name: Tetrahydro-2-methyl-3-furanthiol
IUPAC: 2,5-Anhydro-1,4-dideoxy-3-thiopentitol
English name: 2-Methyltetrahydrofuran-3-thiol
Molecular formula: C5H10OS
Molecular weight: 118.19

Names & synonyms

2-METHYL-3-TETRAHYDROFURANTHIOLFEMA 37872-METHYLTETRFurfural Impurity 282-Methyloxolane-3-thiolMethyl-3-tetrahydrofuranth2-Metyl-3-tetrahydrofuranthioltetrahydro-2-methyl-3-furanthio2-METHYLTETRAHYDROFURAN-3-THIOLTETRAHYDRO-2-METHYLFURAN-3-THIOL

Database identifiers

CAS: 57124-87-5
PubChem CID: 62128
DTXSID: DTXSID10866614
ChEBI: CHEBI:173449
EC Number: 260-572-4
Nikkaji: J349.088B

Properties

Physicochemical properties

Boiling point: 160 · 160-180 °C
Density: 1.04 g/mL · 1.04 g/mL at 25 °C(lit.)
refractive index: 1.473 · 1.473-1.491
FEMA: 3787 · 3787 | 2-METHYL-3-TETRAHYDROFURANTHIOL
FLAVIS Number: 13.16 · 13.160 | 2-Methyltetrahydrofuran-3-thiol
Flash point: 30 °C · 30 °C
storage temp.: Inert atmosphere,Room Temperature
solubility: Chloroform, Methanol (Slightly)
form: Liquid
pka: 10.13 · 10.13±0.40(Predicted)
color: Clear colorless to pale yellow
Odor: 0.1 % · at 0.10 % in propylene glycol. roasted beef chicken meat sulfurous
Odor Type: meaty
biological source: synthetic
Water Solubility: insoluble
JECFA Number: 1090 · 1090
Major Application: flavors and fragrances
InChI: 1S/C5H10OS/c1-4-5(7)2-3-6-4/h4-5,7H,2-3H2,1H3
InChIKey: DBPHPBLAKVZXOY-UHFFFAOYSA-N
SMILES: CC1OCCC1S
LogP: 0.62 · 0.62
CAS DataBase Reference: 57124 · 57124-87-5(CAS DataBase Reference)
Substances Added to Food (formerly EAFUS): 2 · 2-METHYL-3-TETRAHYDROFURANTHIOL
FDA UNII: 826 F42XX8 · D826F42XX8
EPA Substance Registry System: 3 · 3-Furanthiol, tetrahydro-2-methyl- (57124-87-5)
UNSPSC Code: 12164502 · 12164502
NACRES: 21 · NA.21
Symbol(GHS): 2 · GHS02,GHS07
Signal word: Warning
Hazard statements: 226 · H226-H315-H319-H335
Precautionary statements: 210 · P210-P302+P352-P305+P351+P338
target organs: Respiratory system
PPE: Eyeshields, Faceshields, Gloves, type ABEK (EN14387) respirator filter
Hazard Codes: Xi
Risk Statements: 36 · 36/38-10-36/37/38
Safety Statements: 37 · 37/39-26-16-36-24/25-23
RIDADR: 1993 · 1993
WGK Germany: 3 · 3
TSCA: TSCA listed
HazardClass: 3 · 3
PackingGroup: III
HS Code: 29321900 · 29321900
Storage Class: 3 · 3 - Flammable liquids
Hazard Classifications: 2 Flam · Eye Irrit. 2Flam. Liq. 3Skin Irrit. 2STOT SE 3
Limited Quantities: 5 L · 5.0 L (1.3 gallons) (liquid)
Excepted Quantities: Max Inner Pack (30g or 30ml) and Max Outer Pack (1Kg or 1L)

Safety & regulation

Safety data

PPE: Eyeshields, Faceshields, Gloves, type ABEK (EN14387) respirator filter
wgk: 3
tsca: TSCA listed
ridadr: 1993
hs_code: 29321900
risk_code: 36/38-10-36/37/38
Signal word: Warning
Symbol(GHS): GHS02,GHS07
hazard_code: Xi
safety_code: 37/39-26-16-36-24/25-23
hazard_class: 3
Storage Class: 3 - Flammable liquids
packing_group: III
target organs: Respiratory system
Hazard statements: H226-H315-H319-H335
Limited Quantities: 5.0 L (1.3 gallons) (liquid)
Excepted Quantities: Max Inner Pack (30g or 30ml) and Max Outer Pack (1Kg or 1L)
Hazard Classifications: Eye Irrit. 2Flam. Liq. 3Skin Irrit. 2STOT SE 3
Precautionary statements: P210-P302+P352-P305+P351+P338

Chemistry & industry

Applications · 3 items

OccurrenceReported found in heated pork meat

Uses2-Methyltetrahydrofuran-3-thiol is a compound used as flavor

General Description2-Methyl-3-tetrahydrofuranthiol is a sulfur-containing flavor compound mainly used in meat flavorings.

Upstream & downstream products

Upstream raw materials

Downstream products

Pentitol, 1,4-anhydro-2,5-dideoxy-3-S-(3-iodo-4-quinolinyl)-3-thio-

Suppliers50 total

梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]

上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]

Shandong chuangyingchemical Co., Ltd.18853181302 · [email protected]

枣庄九星生物科技有限公司0632-3759569 13589608009

武汉欣扬瑞和化学科技有限公司13720274133 · [email protected]

Additional notes

DefinitionChEBI: Tetrahydro-2-methyl-3-furanthiol is a member of oxolanes.

Related reactions

0 records

New reaction record

No reaction records under the current filter.

Linked notes

Loading…