2 에틸부틸알데히드

2-Ethylbutyraldehyde

HCID 7359CAS 97-96-1

기본 정보

표준 SMILES
CCC(C=O)CC
InChIKey
UNNGUFMVYQJGTD-UHFFFAOYSA-N
분자식
C6H12O
평균 분자량
100.16 g/mol
단동위원소 질량
100.088815

개요

2-ethylbutyraldehyde appears as a clear colorless liquid. Less dense than water and insoluble in water. Vapors heavier than air.

이름 및 식별자

우선 이름
2-Ethylbutyraldehyde
IUPAC
2-ethylbutanal
현지명
2 에틸부틸알데히드
영어명
2-Ethylbutyraldehyde
분자식
C6H12O
분자량
100.16

이름 및 동의어

2-Ethylbutanal2-ETHYLBUTYRALDEHYDE97-96-1Butanal, 2-ethyl-Diethylacetaldehyde3-Formylpentane2-Ethylbutyric aldehydeButyraldehyde, 2-ethyl-alpha-EthylbutanalEthyl butyraldehyde2-Ethylbutyric aledhydeDiethyl acetaldehyde
이름 더 보기
2에틸부틸알데히드2-에틸하이드록시알데하이드FEMA 24263-ethylpentanal(C2H5)2CHCHO2-ethyl-butanaα-Ethylbutanal2-ethylbutyral
Aldehyde 2-ethylbutyriqueEthylbutyraldehydealpha-EthylbutyraldehydeFEMA No. 2426NSC 6757DTXSID3049380Aldehyde 2-ethylbutyrique [French]EINECS 202-623-5

데이터베이스 식별자

CAS
97-96-1
PubChem CID
7359
DTXSID
DTXSID3049380
ChEMBL
CHEMBL273782
ChEBI
CHEBI:173345
UNII
676JY5569P
EC Number
202-623-5
Nikkaji
J35.112A

물성

구조 계산 물성

XLogP
1.5
극성 표면적
17.1 Ų
수소 결합 공여자 수
0
수소 결합 수용자 수
1
회전 가능 결합 수
3
무거운 원자 수
7

실험 및 물리화학적 성질

Chemical ClassesFlammable agents - 3rd degree
SpringerMaterials PropertiesChemical shift
Food AdditivesFLAVORING AGENT OR ADJUVANT -> FDA Substance added to food
Density0.808-0.814
Flavoring AgentsEU Flavoring substances
Solubility · 2건

miscible with alcohol, ether; soluble in water 1 ml in 50 ml

(in ethanol)

물리화학적 성질

녹는점
-89 °C · -89°C
끓는 점
117 °C · 117 °C(lit.)
밀도
0.814 g/mL · 0.814 g/mL at 25 °C(lit.)
굴절률
20 · n20/D 1.402(lit.)
FEMA
2426 · 2426 | 2-ETHYLBUTYRALDEHYDE
인화점
70 °F · 70 °F

화학적 성질

2-Ethylbutyraldehyde has a pungent odor.

안전 및 규제

GHS 분류

GHS Classification · 4건

Danger

H225 (13.2%): Highly Flammable liquid and vapor [Danger 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 1495 reports by companies from 13 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

유해성 정보

Regulatory Information · 4건

Chemical: Butanal, 2-ethyl-

Butanal, 2-ethyl- is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of Butanal, 2-ethyl- are required to report information about their production and use of this chemical to the EPA under the Toxic Substances Control Act (TSCA). (40 eCFR Part 711)

Butanal, 2-ethyl-: 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 · 2건

Excerpt from ERG Guide 130 [Flammable Liquids (Water-Immiscible / Noxious)]:

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

Health Hazards · 2건

Excerpt from ERG Guide 130 [Flammable Liquids (Water-Immiscible / Noxious)]:

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

DOT ID and Guide1178 130
Reactive GroupAldehydes

안전 및 보호

Fire FightingExcerpt from ERG Guide 130 [Flammable Liquids (Water-Immiscible / Noxious)]:
Accidental Release Measures · 2건

· 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 · 2건

Excerpt from ERG Guide 130 [Flammable Liquids (Water-Immiscible / Noxious)]:

General First Aid:

Exposure Control and Personal Protection· Wear positive pressure self-contained breathing apparatus (SCBA).
Nonfire Spill ResponseExcerpt from ERG Guide 130 [Flammable Liquids (Water-Immiscible / Noxious)]:
Isolation and Evacuation · 2건

Excerpt from ERG Guide 130 [Flammable Liquids (Water-Immiscible / Noxious)]:

Immediate precautionary measure

안전 데이터

wgk
1
tsca
TSCA listed
rtecs
ES2625000
ridadr
UN 1178
HS 번호
29121900
risk_code
11-36/37/38

화학 및 산업

약리 정보

Cellular LocationsCytoplasm

용도 및 제조

U.S. Production2022: <50,000 lb
Consumer UsesFragrance
Use Classification · 2건

Flavouring Agent -> FLAVOURING_AGENT -> JECFA Functional Classes

Flavoring Agents -> JECFA Flavorings Index

General Manufacturing InformationButanal, 2-ethyl-: ACTIVE
응용 분야 · 3건

출처Reported found in melon, French fried potato, wheaten bread, scallops, citrus fruits, white bread and maize.

용도2-Ethylbutyraldehyde has been used in the preparation of aldoximes using aqueous hydroxylamine.

일반 설명A clear colorless liquid. Flash point 70°F. Less dense than water and insoluble in water. Vapors heavier than air.

공급사50 곳

山东玖玥生物科技有限公司15553333686
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]
Hebei baicao biology science and technology co., ltd+86-19131911055 17824879454 · [email protected]
杭州品高化工有限公司0571-87658025 · [email protected]

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74건

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