Cyclohexanthiol

Cyclohexanethiol

HCID 15290CAS 1569-69-3

Grundinformationen

Standard-SMILES
SC1CCCCC1
InChIKey
CMKBCTPCXZNQKX-UHFFFAOYSA-N
Summenformel
C6H12S
Durchschnittliche Molmasse
116,23 g/mol
Monoisotopische Masse
116,06597138

Überblick

Cyclohexanethiol appears as a colorless liquid with a strong disagreeable odor. Insoluble in water and less dense than water. Vapors heavier than air. Flash point near 50 °F.

Namen und Bezeichner

Bevorzugter Name
Cyclohexanethiol
IUPAC
cyclohexanethiol
Lokaler Name
Cyclohexanthiol
Englischer Name
Cyclohexyl mercaptan
Summenformel
C6H12S
Molmasse
116.22

Namen und Synonyme

CYCLOHEXANETHIOLCyclohexyl mercaptanCyclohexyl thiolCyclohexylmercaptanCyclohexylthiolCyklohexylmerkaptanCyklohexanthiolMercaptocyclohexaneCyklohexanthiol [Czech]Cyklohexylmerkaptan [Czech]DTXSID2027416HSDB 5840
Weitere Namen anzeigen
Cyclohexanthiol2,3-DIFLUORO-5-NITROPHENOLTHIOCYCLOHEXANE1-CyclohexanethiolohexanethioL
EINECS 216-378-7UNII-N8HOD9900VNSC 59723UN3054BRN 1236342NSC-59723CYCLOHEXANETHIOL [HSDB]DTXCID207416

Datenbank-Bezeichner

CAS
1569-69-3
PubChem CID
15290
DTXSID
DTXSID2027416
ChEMBL
CHEMBL3187982
UNII
N8HOD9900V
EC Number
216-378-7
Nikkaji
J13.114H

Eigenschaften

Berechnete Struktureigenschaften

XLogP
2,7
Polarare Oberfläche (TPSA)
1 Ų
H-Brücken-Donoren
1
H-Brücken-Akzeptoren
1
Frei drehbare Bindungen
0
Schwere Atome
7

Experimentelle und physikochemische Eigenschaften

Chemical Classes · 2 Einträge

Other Classes -> Thiols

Flammable agents - 2nd degree

SpringerMaterials PropertiesBoiling point
OdorStrong offensive odor.
Density · 4 Einträge

0.98 (NIOSH, 2024) - Less dense than water; will float

0.9782 @ 20 °C/4 °C

Relative density (water = 1): 0.98

0.98

Color/Form · 2 Einträge

Liquid

Colorless liquid.

Solubility · 5 Einträge

Insoluble (NIOSH, 2024)

SOL IN ALCOHOL, ETHER, ACETONE, BENZENE, CHLOROFORM

Soluble in oxygenated and chlorinated solvents.

Solubility in water: none

Insoluble

Physikochemische Eigenschaften

Schmelzpunkt
-30 °C · -30 °C
Siedepunkt
158 · 158-160 °C (lit.)
Dichte
0.95 g/mL · 0.95 g/mL at 25 °C (lit.)
Dampfdichte
4 · 4 (vs air)
Dampfdruck
10.3 mm · 10.3 mm Hg ( 37.7 °C)
Brechungsindex
20 · n20/D 1.493(lit.)

Sicherheit und Regulatorisches

GHS-Klassifizierung

GHS Classification · 4 Einträge

Warning

H226 (100%): Flammable liquid and vapor [Warning Flammable liquids]

P210, P233, P240, P241, P242, P243, P261, P264, P264+P265, P270, P271, P273, P280, P301+P317, P302+P352, P303+P361+P353, P304+P340, P305+P351+P338, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P370+P378, P391, P403+P233, P403+P235, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 48 reports by companies from 8 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Gefahrenhinweise

Regulatory Information · 4 Einträge

Chemical: Cyclohexanethiol

Status: Active Update: 17-04-2013 https://echa.europa.eu/registration-dossier/-/registered-dossier/11526

Cyclohexanethiol: Does not have an individual approval but may be used under an appropriate group standard

The New Jersey Worker and Community Right to Know Act requires public and private employers to provide information about hazardous substances at their workplaces. (N.J.S.A. 34:5A-1 et. seq.)

DOT LabelFlammable Liquid
Fire Hazards · 4 Einträge

Excerpt from ERG Guide 129 [Flammable Liquids (Water-Miscible / Noxious)]:

· HIGHLY FLAMMABLE: Will be easily ignited by heat, sparks or flames.

· HIGHLY FLAMMABLE: Will be easily ignited by heat, sparks or flames.

Flammable. Above 43 °C explosive vapour/air mixtures may be formed.

Health Hazards · 3 Einträge

Excerpt from ERG Guide 129 [Flammable Liquids (Water-Miscible / Noxious)]:

· May cause toxic effects if inhaled or absorbed through skin.

· May cause toxic effects if inhaled or absorbed through skin.

Hazards SummarySee THIOLS;
DOT ID and Guide · 3 Einträge

3054 129

3054 129

3054 129

Sicherheit und Schutzausrüstung

Fire Fighting · 2 Einträge

Excerpt from ERG Guide 129 [Flammable Liquids (Water-Miscible / Noxious)]:

Use foam, carbon dioxide, powder. In case of fire: keep drums, etc., cool by spraying with water.

First Aid Measures · 4 Einträge

Fresh air, rest. Refer for medical attention.

Remove contaminated clothes. Rinse skin with plenty of water or shower.

First rinse with plenty of water for several minutes (remove contact lenses if easily possible), then refer for medical attention.

Rinse mouth. Give one or two glasses of water to drink. Refer for medical attention .

Accidental Release Measures · 4 Einträge

· CALL 911. Then call emergency response telephone number on shipping paper. If shipping paper not available or no answer, refer to appropriate telephone number listed on the inside back cover.

· ELIMINATE all ignition sources (no smoking, flares, sparks or flames) from immediate area.

· CALL 911. Then call emergency response telephone number on shipping paper. If shipping paper not available or no answer, refer to appropriate telephone number listed on the inside back cover.

· ELIMINATE all ignition sources (no smoking, flares, sparks or flames) from immediate area.

First Aid · 4 Einträge

Excerpt from NIOSH Pocket Guide for Cyclohexanethiol:

General First Aid:

General First Aid:

(General first aid procedures)

Safe StorageFireproof. Separated from reducing agents, metals and strong oxidants.
Exposure Control and Personal Protection · 2 Einträge

· Wear positive pressure self-contained breathing apparatus (SCBA).

· Wear positive pressure self-contained breathing apparatus (SCBA).

Toxikologische Informationen

Target OrgansEyes, skin, respiratory system, central nervous system
Adverse EffectsOther Poison - Chemical Asphyxiant
Exposure Routes · 2 Einträge

The substance can be absorbed into the body by inhalation and by ingestion.

inhalation, skin absorption, ingestion, skin and/or eye contact

Signs and Symptoms · 5 Einträge

Cough. Dizziness. Headache. Nausea. Drowsiness. Vomiting. Weakness. Unconsciousness.

Redness. Pain.

Redness. Pain.

See Inhalation.

irritation eyes, skin, respiratory system; headache, dizziness, lassitude (weakness, exhaustion), nausea, vomiting, convulsions; cough, wheezing, laryngitis, dyspnea (breathing difficulty)

Sicherheitsdaten

OEL
Ceiling: 0.5 ppm (2.4 mg/m3) [15-minute]
wgk
3
tsca
TSCA listed
ridadr
UN 3054
hs_code
29309070
RTECS-Nr.
GV7525000

Chemie und Industrie

Verwendung und Herstellung

Methods of Manufacturingcyclohexene + hydrogen sulphide (thiolation)
General Manufacturing InformationCyclohexanethiol: ACTIVE

Anbieter50 Anbieter

梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
阿诺西(上海)生物技术有限公司400-1107768 15058188853 · [email protected]
山东旭晨化工科技有限公司0533-15715337262 15715337262 · [email protected]
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
Hebei Chuanghai Biotechnology Co., Ltd+86-17732866630 · [email protected]

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