2-Hexanol (HCID 12297)

개요

Hexan-2-ol is a hexanol in which the hydroxy group is at position 2. It has a role as a semiochemical, a plant metabolite and a human metabolite. It is a hexanol and a secondary alcohol.

이름 및 식별자

우선 이름: 2-Hexanol
IUPAC: hexan-2-ol
현지명: (R)-(-)-2-헥사놀
영어명: (R)-(-)-2-HEXANOL
분자식: C6H14O
분자량: 102.17

이름 및 동의어

2-HEXANOLhexan-2-ol626-93-72-Hydroxyhexane2-Hexyl Alcohol9CDT0V6T4PNSC-3706CHEBI:88370DTXSID30893088(+-)-2-HexanolRefChem:909857DTXCID70811105

이름 더 보기

(R)-(-)-2-헥사놀(R)-Hexan-2-ol(R)-2-HEXANOL(2R)-2-Hexanol(2R)-Hexan-2-ol2-Hexanol, (2R)-(R)-(-)-2-hexylol(R)-(-)-2-HEXANOLRARECHEM AK HZ 0015(R)-(-)-2-HEXANOL 99%(R)-(-)-2-HYDROXYHEXANE

210-971-4(+/-)-2-HexanolMFCD00004585n-C4H9CH(OH)CH354972-97-32-Hexanol, (S)-Hexan-2-ol; 2-Hexanol69203-06-1

데이터베이스 식별자

CAS: 26549-24-6、37769-60-1、52019-78-0、54972-97-3、626-93-7、69203-06-1
PubChem CID: 12297
DTXSID: DTXSID30893088
ChEMBL: CHEMBL45425
ChEBI: CHEBI:88370
UNII: 9CDT0V6T4P
EC Number: 210-971-4
Nikkaji: J1.693D

물성

구조 계산 물성

XLogP: 1.8
극성 표면적: 20.2 Å²
수소 결합 공여자 수: 1
수소 결합 수용자 수: 1
회전 가능 결합 수: 3
무거운 원자 수: 7
형식 전하: 0
복잡도: 35.2

실험 및 물리화학적 성질

LipidsFatty Acyls [FA] -> Fatty alcohols [FA05]

SolventsSolvents -> Alcohols (<C12)

LogP1.76

Density · 2건

Relative density (water = 1): 0.8

0.814 @25 °C

SolubilitySolubility in water: poor

Flash Point41 °C

물리화학적 성질

녹는점: -48.42 °C · -48.42°C (estimate)
끓는 점: 137 · 137-138 °C(lit.)
밀도: 0.814 g/mL · 0.814 g/mL at 20 °C(lit.)
굴절률: 20 · n20/D 1.414(lit.)
인화점: 124 °F · 124 °F
저장 조건: Store at room temperature
산도 계수 (pKa): 15.31 · 15.31±0.20(Predicted)
냄새: 100 %에서 · 100.00%에서. 버섯 먼지가 많은 기름진
냄새 유형: 땅의
LogP: 1.754 · 1.754 (est)

화학적 성질

Colorless to light yellow liqui

안전 및 규제

GHS 분류

GHS Classification · 4건

Warning

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

P210, P233, P240, P241, P242, P243, P261, P264, P264+P265, P270, P271, 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, P403+P233, P403+P235, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 267 reports by companies from 10 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

유해성 정보

Regulatory Information · 3건

Chemical: 2-Hexanol

1-Pentanol, methyl-: Does not have an individual approval but may be used as a component in a product covered by a group standard. It is not approved for use as a chemical in its own right.

2-Hexanol: HSNO Approval: HSR001168 Approved with controls

Other Safety InformationEvaluation - Chemicals that are unlikely to require further regulation to manage risks to environment

Fire HazardsFlammable. Above 41 °C explosive vapour/air mixtures may be formed.

Hazards Summary · 1건

Causes somnolence after oral doses to guinea pigs; Causes changes in peripheral nerve recordings after intraperitoneal doses to rats; [RTECS] A skin irritant; Can be absorbed through skin; Defats the skin; The substance may have effects on the nervous system, resulting in peripheral neuropathy. [ICSC] A mild skin irritant; [eChemPortal: ERMA] An irritant; Targets nerves; [MSDSonline] See n-Hexane.

UN ClassificationUN Hazard Class: 3; UN Pack Group: III

Chemical DangersReacts with strong oxidants.

안전 및 보호

Fire FightingUse foam, alcohol-resistant foam, powder, carbon dioxide. In case of fire: keep drums, etc., cool by spraying with water.

First Aid Measures · 4건

Fresh air, rest. Refer for medical attention.

Remove contaminated clothes. Rinse skin with plenty of water or shower. Refer for medical attention .

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

Rinse mouth. Refer for medical attention .

Safe StorageFireproof. Separated from strong oxidants.

Spillage Disposal · 1건

Personal protection: filter respirator for organic gases and vapours adapted to the airborne concentration of the substance. Do NOT let this chemical enter the environment. Collect leaking and spilled liquid in sealable containers as far as possible. Absorb remaining liquid in earth, sand or inert absorbent. Then store and dispose of according to local regulations.

Eye PreventionWear face shield.

Fire PreventionNO open flames, NO sparks and NO smoking. Above 41 °C use a closed system, ventilation and explosion-proof electrical equipment.

독성 정보

Adverse EffectsNeurotoxin - Acute solvent syndrome

Exposure RoutesThe substance can be absorbed into the body by inhalation and through the skin.

Signs and SymptomsDry skin. Redness.

ICSC Environmental DataThis substance may be hazardous to the environment. Special attention should be given to algae. Environmental effects from the substance have not been investigated adequately.