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테트라데칸알

Tetradecanal

HCID 31291
노트반응
기본 정보이름 및 식별자물성안전 및 규제화학 및 산업관련 반응화합물 노트
부분 구조 검색유사 구조 찾기

기본 정보

CAS
124-25-4
표준 SMILES
CCCCCCCCCCCCCC=O
InChIKey
UHUFTBALEZWWIH-UHFFFAOYSA-N
분자식
C14H28O
평균 분자량
212.37 g/mol
단동위원소 질량
212.21401551

이름 및 식별자

우선 이름
Tetradecanal
IUPAC
tetradecanal
현지명
테트라데칸알
영어명
Tetradecanal
분자식
C14H28O
분자량
212.37

이름 및 동의어

TETRADECANAL124-25-4MyristaldehydeMyristic aldehyden-TetradecanalTetradecyl aldehyde1-TetradecanalTetradecylaldehydeMyristylaldehydeFEMA No. 276344AJ2LT15NNSC-66435
이름 더 보기
테트라데칸알FEMA 27631-tetradecylaldehyde1-Tetradecyl aldehydeALDEHYDE C-14 MYRISTICNSC 66435
CHEBI:84067RefChem:188488204-692-7Aldehyde C-14Myristyl AldehydeC-14 aldehyde, myristicAldehyde C-14, myristicn-Tetradecyl aldehyde

데이터베이스 식별자

CAS
124-25-4
PubChem CID
31291
DTXSID
DTXSID1021665
ChEMBL
CHEMBL2228569
ChEBI
CHEBI:84067
UNII
44AJ2LT15N
EC Number
204-692-7
Nikkaji
J1.509A

물성

구조 계산 물성

XLogP
6
극성 표면적
17.1 Ų
수소 결합 공여자 수
0
수소 결합 수용자 수
1
회전 가능 결합 수
12
무거운 원자 수
15
형식 전하
0
복잡도
121

실험 및 물리화학적 성질

Density0.825-0.830
Solubility · 2건

soluble inmost organic solvents; Insoluble in water

1 ml in 1 ml of 80% alcohol (in ethanol)

Boiling Point · 2건

166.00 °C. @ 24.00 mm Hg

260 °C

Melting Point30 °C
Refractive Index1.438-1.445
Physical Description · 2건

Solid

colourless to pale yellow liquid/fatty, orris-like odour

Kovats Retention Index · 3건

1592;1596;1588;1588;1595;1596;1596;1607;1596;1593;1591;1592;1594;1621;1592;1592;1591;1592;1607;1601

1632;1606;1611;1614.5;1581;1607;1611;1625;1613;1615;1613;1611;1605;1611;1612;1600;1609;1612;1609;1605

1919;1924;1921;1927;1940;1940;1940;1943;1888;1908;1940;1908;1929;1910;1920;1927;1927;1933;1937;1935

물리화학적 성질

녹는점
23 °C · 23°C(lit.)
끓는 점
166 °C/24mmHg · 166°C/24mmHg(lit.)

안전 및 규제

안전 정보는 참고용이며, 공급업체의 물질안전보건자료(SDS), 관련 법규 및 전문가 평가를 대체하지 않습니다.

GHS 분류

GHS Classification · 6건

This chemical does not meet GHS hazard criteria for 0.9% (13 of 1463) of reports.

Warning

H315 (99.1%): Causes skin irritation [Warning Skin corrosion/irritation];H319 (99.1%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]

P264, P264+P265, P280, P302+P352, P305+P351+P338, P321, P332+P317, P337+P317, and P362+P364 (click each P-code to see the statement)

Aggregated GHS information provided per 1463 reports by companies from 4 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.;Reported as not meeting GHS hazard criteria per 13 of 1463 reports by companies.;There are 2 notifications provided by 1450 of 1463 reports by companies with hazard statement code(s).;Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website.

유해성 정보

Regulatory Information · 2건

Chemical: Tetradecanal

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

Other Safety InformationIMAP assessments - Tetradecanal: Environment tier I assessment
Hazard Classes and CategoriesSkin Irrit. 2 (99.1%);Eye Irrit. 2 (99.1%)

규제 정보

Regulatory Information · 2건

Chemical: Tetradecanal

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

화학 및 산업

약리 정보

Cellular LocationsExtracellular;Membrane

용도 및 제조

Household ProductsInformation on 1 consumer products that contain Myristaldehyde in the following categories is provided:;• Commercial / Institutional
Use Classification · 3건

Flavouring Agent -> FLAVOURING_AGENT -> JECFA Functional Classes

Flavoring Agents -> JECFA Flavorings Index

Flavouring Agent -> FLAVOURING_AGENT -> JECFA Functional Classes

General Manufacturing InformationTetradecanal: ACTIVE
응용 분야 · 3건

개요Myristaldehyde (Tetradecanal) has a strong, fatty, orris-like odor with a sweet, fatty, “citrus-peel” flavor (diluted). Industrially prepared from the corresponding myristic acid.

출처Tetradecanal is reported found in the essential oils of Ocotea usambarensis Engl., Pinus sabiniana Dougl.; also reported found in kumquat peel, ginger, chicken fat, hop oil, apricot, citrus peel oils and juices, bilberry, blackberry, cucumber, cassia leaf, butter, parmesan cheese, milk powder, cooked chicken, beef, cured pork, beer, peanuts, trassi, coriander leaf, dried bonito, cherimoya, mountain papaya, scallop and angelica root oil.

용도A major component of the essential oil found in the leaves of Azadirachta indica.

제조 방법

Industrially prepared from the corresponding myristic acid

상·하류 제품 정보

상류 원료

관련 반응

8건
반응 기록 만들기
HRID 6944 반응식
HRID 6944반응물로uspto-grants-2006_08
HRID 526293 반응식
HRID 526293생성물로uspto-grants-2016_05
HRID 664822 반응식
HRID 664822생성물로Training data from https://doi.org/10.1039/C8SC04228D (3/10)
HRID 974280 반응식
HRID 974280반응물로uspto-grants-1991_11
HRID 1086005 반응식
HRID 1086005반응물로uspto-grants-1991_04
HRID 1553285 반응식
HRID 1553285반응물로Training data from https://doi.org/10.1039/C8SC04228D (1/10)
HRID 1710171 반응식
HRID 1710171생성물로uspto-grants-1990_08
HRID 1872803 반응식
HRID 1872803반응물로uspto-grants-2000_08

화합물 노트

불러오는 중…

이 페이지에서기본 정보이름 및 식별자물성안전 및 규제화학 및 산업관련 반응화합물 노트
밀도
0.8278 · 0.8278
굴절률
1.441 · 1.4410
FEMA
2763 · 2763 | MYRISTALDEHYDE
저장 조건
-20 °C · Inert atmosphere,Store in freezer, under -20°C
용해도
클로로포름(약간 용해됨), 에틸아세테이트(약간 용해됨), 메탄올(약간 용해됨)
물리적 상태
고체
색상
흰색에서 진한 주황색까지
냄새
100 %에서 · 100.00%에서. 지방 밀랍 호박 향 건조 감귤 껍질 사향
냄새 유형
밀랍같은
JECFA Number
112 · 112
Henry's Law Constant
8 · 8.0×10-4 mol/(m3Pa) at 25℃, Yaws (2003)
화장품 원료 기능
향수
InChI
InChI=1S/C14H28O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15/h14H,2-13H2,1H3
InChIKey
UHUFTBALEZWWIH-UHFFFAOYSA-N
SMILES
C(=O)CCCCCCCCCCCCC
LogP
6.01 · 6.01
EPA
Tetradecanal (124-25-4)

화학적 성질

White Semi-Solid

안전 데이터

tsca
TSCA listed
rtecs
XB7900000
독성
The acute oral LD50 value was reported as > 5Og/kg in the rat . The acute dermal LD50 for sample no. 71-17 was reported to be > 10 g/kg
HS 번호
2912190090
risk_code
36/37/38
hazard_code
Xi
safety_code
26-37/39
기존화학 물질
KE-33331
미리스트 산
1-옥타놀
아크릴산메틸
미리스틱 알코올 (N-테트라데칸올)
Giner Oil
미리스틸미리스테이트

하류 제품

2-헥사데센산

공급사100 곳

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추가 설명

정의ChEBI: A long-chain fatty aldehyde that is tetradecane in which two hydrogens attached to a terminal carbon are replaced by an oxo group. It is found in coriander.