1-Pentyne (HCID 12309)

이름 및 식별자

우선 이름: 1-Pentyne
IUPAC: pent-1-yne
현지명: 펜틴(1-)
영어명: 1-Pentyne
분자식: C5H8
분자량: 68.12

이름 및 동의어

1-PENTYNEpent-1-yne627-19-0PropylacetyleneMFCD00009469Acetylene, propyl-EW8XD8E5WFPentyne1-Pentine; Propylacetylene1-Pentyne, 99%pentinpentyn

이름 더 보기

1-펜타인펜틴(1-)1-펜타인(1-PENTYNE)1-펜틴n-Propyl acetylene1-Pentinl-pentyneC3H7CequivCH1-Pentyne>1-Pentyne,99%1-Pentyne 99%1-PENTYNE 98+%

n-pentyne1-n-pentyneEINECS 210-987-1AI3-37709UNII-EW8XD8E5WFSCHEMBL8331SCHEMBL8451SCHEMBL22821

데이터베이스 식별자

CAS: 627-19-0
PubChem CID: 12309
DTXSID: DTXSID7060835
ChEMBL: CHEMBL16262
UNII: EW8XD8E5WF
EC Number: 210-987-1
Nikkaji: J43.570H

물성

구조 계산 물성

XLogP: 2
극성 표면적: 0 Å²
수소 결합 공여자 수: 0
수소 결합 수용자 수: 0
회전 가능 결합 수: 1
무거운 원자 수: 5
형식 전하: 0
복잡도: 44.3

실험 및 물리화학적 성질

Chemical ClassesOther Classes -> Aliphatics, Unsaturated

SpringerMaterials PropertiesCoriolis coupling

LogP1.98

Vapor Pressure436.0 [mmHg]

Physical DescriptionColorless liquid; Not miscible or difficult to mix in water; [MSDSonline]

물리화학적 성질

녹는점: -106 °C · -106 °C
끓는 점: 40 °C · 40 °C(lit.)
밀도: 0.691 g/mL · 0.691 g/mL at 25 °C(lit.)
증기압: 6.8 psi · 6.8 psi ( 20 °C)
굴절률: 20 · n20/D 1.385(lit.)
인화점: -34 °C · -34°C
저장 조건: 2 °C · Store at +2°C to +8°C.
용해도: 1.05 g/L · 1.05g/L
물리적 상태: 액체
색상: 무색~담황색 투명
수용성: 물에 용해됩니다. (1.05g/L), 20°C에서.
BRN: 1697133 · 1697133
Henry's Law Constant: 3.9 · 3.9×10-4 mol/(m3Pa) at 25℃, Brockbank (2013)
InChI: 1S/C5H8/c1-3-5-4-2/h1H,4-5H2,2H3
InChIKey: IBXNCJKFFQIKKY-UHFFFAOYSA-N
SMILES: CCCC#C
EPA: 1 · 1-Pentyne (627-19-0)

화학적 성질

Clear colorless to pale yellow liquid

안전 및 규제

GHS 분류

GHS Classification · 4건

Danger

H225 (98.1%): Highly Flammable liquid and vapor [Danger Flammable liquids]

P210, P233, P240, P241, P242, P243, P261, P264, P264+P265, P271, P280, P301+P316, P302+P352, P303+P361+P353, P304+P340, P305+P351+P338, P319, P321, P331, 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 53 reports by companies from 5 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

유해성 정보

Regulatory Information1-Pentyne: Does not have an individual approval but may be used under an appropriate group standard

Hazards SummaryA skin and eye irritant; [eChemPortal: ERMA] An irritant; [MSDSonline] See Methylacetylene.

Hazard Classes and CategoriesFlam. Liq. 2 (98.1%)

독성 정보

Adverse EffectsNeurotoxin - Acute solvent syndrome

안전 데이터

wgk: 3
tsca: TSCA listed
ridadr: UN 3295 3/PG 2
HS 번호: 2901 29 00
risk_code: 11-36/37/38-65
hazard_code: F,Xn
safety_code: 16-26-36-62
포장분류: II
위험 등급: 3
기존화학 물질: KE-28120
Hazard Classifications: Flam. Liq. 2
스토리지 클래스: 3 - Flammable liquids

화학 및 산업

용도 및 제조

General Manufacturing Information1-Pentyne: ACTIVE

응용 분야

용도1-Pentyne has been used in preparation of:lithium acetylides, required for asymmetric synthesis of α,α-dibranched propargyl sulfinamides. It is also used to synthesize 7-hydroxy-10-methoxy-3H-naphtho[2.1-b]pyrans.

일반 설명Selective and non-selective hydrogenation of 1-pentyne catalyzed by silica-supported palladium has been studied by in situ X-ray absorption spectroscopy.

상·하류 제품 정보

상류 원료

2-브로모-1-펜텐 Cyclopropene, 1,2-dipropyl-2-hexynal 1-(트리페닐-람다5-포스파닐리덴)-펜탄-2-온 1,2-디브로모펜탄 DIPROPYL설페이트 1-(트리메틸실릴)-1-펜타인 3-(4-메톡시페닐)-2-프로피노산(염분데이터:무료)1-브로모프로판

하류 제품

3-HEPTEN-2-ONE Methyl 2-hexynoate 1-Phenyl-1-pentyne 시스-2-펜텐 2-Hexynoic acid

공급사40 곳

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

江苏星科元信息科技有限公司400-605-7200 15335295587

T&W GROUP021-61551611 13296011611 · [email protected]

上海仲因实业有限公司2537653158 16621191650 · [email protected]

上海迈瑞尔生化科技有限公司4006356688 18621169109 · [email protected]

연결된 노트

불러오는 중…

1-Pentyne

기본 정보