3-Pentyn-1-ol (HCID 66295)

이름 및 식별자

우선 이름: 3-Pentyn-1-ol
IUPAC: pent-3-yn-1-ol
현지명: 펜틴(3-)-1-올
영어명: 3-PENTYN-1-OL
분자식: C5H8O
분자량: 84.12

이름 및 동의어

3-Pentyn-1-olpent-3-yn-1-ol10229-10-4MFCD000029563-pentynolEINECS 233-550-7AI3-372563-Pentyn-1-ol, 97%SCHEMBL487343SCHEMBL710650SCHEMBL964462SCHEMBL6903394

이름 더 보기

3-펜틴-1-올펜틴(3-)-1-올3-pentyne-1-ol3-Pentyn-1-ol>3-PENTYN-1-OL 99%3-PENTYN-1-OL, 98%3-PENTYN-1-OL, 98%3-PENTYN-1-OL, 98%

SCHEMBL7366071DTXSID60650083-PENTYN-1-OL 99%3-Pentyn-1-ol, 99% 5GR3-Pentyn-1-ol>3-pentyne-1-ol3-PENTYN-1-OL 99+%SBB009118AKOS009156820

데이터베이스 식별자

CAS: 10229-10-4
PubChem CID: 66295
DTXSID: DTXSID6065008
EC Number: 233-550-7
Nikkaji: J126.450H

물성

구조 계산 물성

XLogP: 0.6
극성 표면적: 20.2 Å²
수소 결합 공여자 수: 1
수소 결합 수용자 수: 1
회전 가능 결합 수: 1
무거운 원자 수: 6
형식 전하: 0
복잡도: 72.4

실험 및 물리화학적 성질

PolymersOther Classes -> Alcohols and Polyols, Other

SpringerMaterials PropertiesOptical coefficient

Physical DescriptionClear dark yellow liquid; [Sigma-Aldrich MSDS]

물리화학적 성질

녹는점: -24.1 °C · -24.1°C (estimate)
끓는 점: 154 · 154-157 °C (lit.)
밀도: 0.912 g/mL · 0.912 g/mL at 25 °C (lit.)
굴절률: 20 · n20/D 1.456(lit.)
인화점: 130 °F · 130 °F
저장 조건: 2 · 2-8°C
산도 계수 (pKa): 14.39 · 14.39±0.10(Predicted)
물리적 상태: 투명한 액체
색상: Colorless to Light yellow to Light orange
Specific Gravity: 0.912 · 0.912
BRN: 1735967 · 1735967
InChI: InChI=1S/C5H8O/c1-2-3-4-5-6/h6H,4-5H2,1H3
InChIKey: IDYNOORNKYEHHO-UHFFFAOYSA-N
SMILES: C(O)CC#CC
LogP: 0.684 · 0.684 (est)
EPA: 3 · 3-Pentyn-1-ol (10229-10-4)

화학적 성질

clear yellow liquid

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, P271, P280, P302+P352, P303+P361+P353, P304+P340, P305+P351+P338, P319, P321, 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 49 reports by companies from 9 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

유해성 정보

Regulatory Information3-Pentyn-1-ol: Does not have an individual approval but may be used under an appropriate group standard

Hazards SummaryA skin and strong eye irritant; [Sigma-Aldrich MSDS]

Hazard Classes and CategoriesFlam. Liq. 3 (100%)

안전 데이터

wgk: 3
tsca: TSCA listed
ridadr: UN 1987 3/PG 3
HS 번호: 29052900
risk_code: 10-36/37/38
hazard_code: Xi
safety_code: 26-36
포장분류: III
위험 등급: 3.2
기존화학 물질: KE-28126
F 고인화성물질: 10
Hazard Classifications: Eye Irrit. 2Flam. Liq. 3Skin Irrit. 2STOT SE 3
스토리지 클래스: 3 - Flammable liquids

화학 및 산업

용도 및 제조

General Manufacturing Information3-Pentyn-1-ol: ACTIVE

응용 분야

용도3-Pentyn-1-ol was used in the synthesis of 4,4-bis(1-methyl-1H-indol-3-yl)pentan-1-ol.

일반 설명Inhibiting effect of 3-pentyn-1-ol on the corrosion of iron in 1M HCl has been investigated. Reaction of 3-pentyn-1-ol with Fe3(CO)12 in CH3OH/KOH solution yields closed trinuclear hydridic complex (μ-H)Fe3(CO)9(μ3-η3-[H3CCC(CH2)(CH2)CO]).