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Tetradecanal

HCID 31291
NotesReactions

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Basic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

CAS
124-25-4
Standard SMILES
CCCCCCCCCCCCCC=O
InChIKey
UHUFTBALEZWWIH-UHFFFAOYSA-N
Molecular formula
C14H28O
Average molar mass
212.37 g/mol
Monoisotopic mass
212.21401551

Names & identifiers

Preferred name
Tetradecanal
IUPAC
tetradecanal
English name
Tetradecanal
Molecular formula
C14H28O
Molecular weight
212.37

Names & synonyms

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

Database identifiers

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

Properties

Computed structural propertiesFilling in

XLogP
6
Topological polar surface area
17.1 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
1
Rotatable bonds
12
Heavy atoms
15
Formal charge
0
Complexity
121

Experimental & physicochemical properties

Density0.825-0.830
Solubility · 2 items

soluble inmost organic solvents; Insoluble in water

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

Boiling Point · 2 items

166.00 °C. @ 24.00 mm Hg

260 °C

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

Solid

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

Kovats Retention Index · 3 items

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

Physicochemical properties

Safety & regulation

Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.

GHS classification

GHS Classification · 6 items

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.

Hazard information

Regulatory Information · 2 items

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%)

Regulatory information

Regulatory Information · 2 items

Chemistry & industry

Pharmacology

Cellular LocationsExtracellular;Membrane

Uses & manufacturing

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

Flavouring Agent -> FLAVOURING_AGENT -> JECFA Functional Classes

Flavoring Agents -> JECFA Flavorings Index

Flavouring Agent -> FLAVOURING_AGENT -> JECFA Functional Classes

General Manufacturing InformationTetradecanal: ACTIVE
Applications · 3 items

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

OccurrenceTetradecanal 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.

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

Preparation methods

PreparationIndustrially prepared from the corresponding myristic acid

Upstream & downstream products

Related reactions

8 records
New reaction record
HRID 6944 reaction equation
HRID 6944As reactantuspto-grants-2006_08
HRID 526293 reaction equation
HRID 526293As productuspto-grants-2016_05
HRID 664822 reaction equation
HRID 664822As productTraining data from https://doi.org/10.1039/C8SC04228D (3/10)
HRID 974280 reaction equation
HRID 974280As reactantuspto-grants-1991_11
HRID 1086005 reaction equation
HRID 1086005As reactantuspto-grants-1991_04
HRID 1553285 reaction equation
HRID 1553285As reactantTraining data from https://doi.org/10.1039/C8SC04228D (1/10)
HRID 1710171 reaction equation
HRID 1710171As productuspto-grants-1990_08
HRID 1872803 reaction equation
HRID 1872803As reactantuspto-grants-2000_08

Compound notes

Loading…

On this pageBasic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
Melting point
23 °C · 23°C(lit.)
Boiling point
166 °C/24mmHg · 166°C/24mmHg(lit.)
Density
0.8278 · 0.8278
refractive index
1.441 · 1.4410
FEMA
2763 · 2763 | MYRISTALDEHYDE
FLAVIS Number
5.032 · 05.032 | Tetradecanal
storage temp.
-20 °C · Inert atmosphere,Store in freezer, under -20°C
solubility
Chloroform (Slightly), Ethyl Acetate (Slightly), Methanol (Slightly)
form
Solid
color
White to Dark Orange
Odor
100 % · at 100.00 %. fatty waxy amber incense dry citrus peel musk
Odor Type
waxy
JECFA Number
112 · 112
Henry's Law Constant
8 · 8.0×10-4 mol/(m3Pa) at 25℃, Yaws (2003)
Cosmetics Ingredients Functions
PERFUMING
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
Substances Added to Food (formerly EAFUS)
MYRISTALDEHYDE
EWG's Food Scores
1 · 1
FDA UNII
44 AJ2LT15N · 44AJ2LT15N
EPA Substance Registry System
Tetradecanal (124-25-4)
Symbol(GHS)
7 · GHS07
Signal word
Warning
Hazard statements
315 · H315-H319
Precautionary statements
264 · P264-P280-P302+P352-P337+P313-P305+P351+P338-P362+P364-P332+P313
Hazard Codes
Xi
Risk Statements
36 · 36/37/38
Safety Statements
26 · 26-37/39
RTECS
7900000 · XB7900000
TSCA
TSCA listed
HS Code
2912190090 · 2912190090
Toxicity
50 value · 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

Chemical: Tetradecanal

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

Safety data

tsca
TSCA listed
rtecs
XB7900000
hs_code
2912190090
Toxicity
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
risk_code
36/37/38
Signal word
Warning
Symbol(GHS)
GHS07
hazard_code
Xi
safety_code
26-37/39
Hazard statements
H315-H319
Precautionary statements
P264-P280-P302+P352-P337+P313-P305+P351+P338-P362+P364-P332+P313

Upstream raw materials

Myristic acid1-OctanolMethyl acrylate1-TetradecanolGiner OilMYRISTYL MYRISTATE

Downstream products

2-Hexadecenoic acid

Suppliers100 total

梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
合肥曼奇诺生物医药技术有限公司19719236623 · [email protected]
成都超九八生物科技有限公司13348960310 13348960310 · [email protected]
武汉欣扬瑞和化学科技有限公司153-07155313 15307155313 · [email protected]
杭州品高化工有限公司0571-87658025 · [email protected]
湖北科乐精细化工有限公司027-59101668 19945030958 · [email protected]
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]
郑州鸿晟医药科技有限公司0371-55695890 15637198702 · [email protected]
毕佳索(上海毕得医药科技股份有限公司)400-6005915 · [email protected]
Syntechem Co.,Ltd[email protected]
北京华威锐科化工有限公司0757-86329057 18934348241 · [email protected]
北京索莱宝科技有限公司010-50973130 17801761073 · [email protected]
安耐吉化学&3A(安徽泽升科技股份有限公司)400-0056266 · [email protected]
梯希爱(上海)化工贸易有限公司021-61109150 · [email protected]
广东方信生物科技有限公司0751-2838688 13376594225 · [email protected]
上海相辉医药科技有限公司13761987713 · [email protected]
武汉丰泰威远科技有限公司+86-27-8746-5837 +86-18627785180 · [email protected]
湖北魏氏化学试剂股份有限公司17771898297 13125137661 · [email protected]
武汉丰泰威远科技有限公司027-87465837 19945049750 · [email protected]
广东元丰化学试剂有限公司0751-2829979 13376591640 · [email protected]
TOKYO CHEMICAL INDUSTRY CO., LTD.03-36680489 · [email protected]
广东顺奥化学试剂有限公司19928586137 · [email protected]
河南赢创生物科技有限公司15672878902 · [email protected]
石家庄琪跃化工有限公司15369111890 · [email protected]
上海贺康生物技术有限公司17721021104 18939837085 · [email protected]
北京汤普森生物科技有限公司+86-13439059536 +86-15201677815 · [email protected]
Labnetwork lnc.+86-27-50766799 +86-18062016861 · [email protected]
湖南华腾制药有限公司400-8592883 15367835770 · [email protected]
上海麦克林生化科技股份有限公司15221275939 15221275939 · [email protected]
杭州杰恒化工有限公司0571-87396432 · [email protected]
陕西缔都医药化工有限公司029-81024372 17792795018 · [email protected]
青岛海智微元生物科技有限公司18317699790 18317699790 · [email protected]
上海兴鲁化工科技有限公司02120970332 · [email protected]
盖米科技(青岛)有限公司19524370118 · [email protected]
凯试(上海)科技有限公司021-50135380 · [email protected]
池州凯隆进出口贸易有限公司[email protected]
桦特昇生物科技(武汉)有限公司027-59207879 1972026995 18140587686 · [email protected]
上海皓之翔生物科技有限公司(原上海拓青化工有限公司)526763801 13301653310 · [email protected]
九鼎化学(上海)科技有限公司4009209199 · [email protected]
韶远科技(上海)有限公司4000665055 · [email protected]
广东翁江化学试剂有限公司0751-2815987 13927875076 · [email protected]
艾吉析科技(上海)有限公司17717235263 17717235263 · [email protected]
上海阿拉丁生化科技股份有限公司6206333 13167063860 · [email protected]
南京世洲生物科技有限公司025-85563444 18351873721 · [email protected]
上海仁实医药科技有限公司021-61150625 18521367657 · [email protected]
上海思言生物科技有限公司021-50908862,442785678,326799392 18721037013 · [email protected]
河南伊诺凯新材料有限公司15764055027 15764055027 · [email protected]
上海源叶生物科技有限公司18916372613 · [email protected]
武汉市承天精细化工有限公司18164098996 · [email protected]
山东西亚化学有限公司4009903999 13395398332 · [email protected]

Additional notes

DefinitionChEBI: 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.