Myristyl bromide

HCID 8208

Basic information

CAS
112-71-0
Standard SMILES
CCCCCCCCCCCCCCBr
InChIKey
KOFZTCSTGIWCQG-UHFFFAOYSA-N
Molecular formula
C14H29Br
Average molar mass
277.28 g/mol
Monoisotopic mass
276.14526303

Names & identifiers

Preferred name
Myristyl bromide
IUPAC
1-bromotetradecane
English name
1-Bromotetradecane
Molecular formula
C14H29Br
Molecular weight
277.28

Names & synonyms

1-Bromotetradecane112-71-0Myristyl bromideTetradecyl bromiden-Tetradecyl bromideTetradecane, 1-bromo-1-Tetradecyl bromiden-Tetradecyl-1-bromideDTXSID3038725NSC 83468GX615908HNEINECS 203-999-3
Show more names
BROMOTETRADECANE1-BromtetradecanTetradecylbromid1-bromo-tetradecan1-tetradecylbromide
NSC-83468DTXCID1018725nTetradecyl bromide1Tetradecyl bromideTetradecane, 1bromoRefChem:819754203-999-3C14H29Br

Database identifiers

CAS
112-71-0
PubChem CID
8208
DTXSID
DTXSID3038725
ChEMBL
CHEMBL3184338
UNII
GX615908HN
EC Number
203-999-3
Nikkaji
J377H

Properties

Computed structural properties

XLogP
8.1
Topological polar surface area
0 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
0
Rotatable bonds
12
Heavy atoms
15

Experimental & physicochemical properties

Chemical ClassesOther Classes -> Halogenated Aliphatics, Saturated
SpringerMaterials PropertiesBoiling point
Physical DescriptionClear yellow liquid; [Acros Organics MSDS]

Physicochemical properties

Melting point
5 · 5-6 °C(lit.)
Boiling point
175 · 175-178 °C20 mm Hg(lit.)
Density
0.932 g/mL · 0.932 g/mL at 25 °C(lit.)
refractive index
20 · n20/D 1.460(lit.)
Flash point
230 °F · >230 °F
storage temp.
30 °C · Store below +30°C.

Safety & regulation

GHS classification

GHS Classification · 5 items

This chemical does not meet GHS hazard criteria for 4.3% (2 of 47) of reports.

Warning

H315 (95.7%): Causes skin irritation [Warning Skin corrosion/irritation]

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 47 reports by companies from 7 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Hazard information

Regulatory Information · 3 items

Chemical: Tetradecane, 1-bromo-

Status: Active Update: 16-12-2016 https://echa.europa.eu/registration-dossier/-/registered-dossier/18555

Tetradecane, 1-bromo-: Does not have an individual approval but may be used under an appropriate group standard

Hazards SummaryMay cause irritation; [Acros Organics MSDS] See Lauryl bromide.
Hazard Classes and CategoriesSkin Irrit. 2 (95.7%)

Safety data

PPE
Eyeshields, Gloves, type ABEK (EN14387) respirator filter
wgk
3
tsca
TSCA listed
hs_code
29033036
risk_code
36/37/38-22
Signal word
Warning

Chemistry & industry

Uses & manufacturing

General Manufacturing InformationTetradecane, 1-bromo-: ACTIVE
Applications · 1 item

Uses1-Bromotetradecane was used in the synthesis of tetradecylferrocene, cationic and zwitterionic gemini surfactants, and 9-tetradecylcarbazole. Also used for synthesis of metallomesogenic polymers based on bis[η1(N)-3,4-dialkyloxybenzylidene-4-dodecyloxyaniline]dichloropalladium(II) with octyl, decyl, dodecyl, tetradecyl and hexadecyl alkyl groups.

Preparation methods · 1 item

Preparation1-Bromotetradecane is synthesized from 1-tetradecanol by bromination. The 1-tetradecanol was added to the reaction pot, and the sulfuric acid was added dropwise with stirring, and the stirring was continued for half an hour after the addition. Then add hydrobromic acid, heat to 99-101°C, and react for 8h. Cool to 30°C, stop stirring, stand for 12 hours, and separate the upper layer of oil, and adjust the pH to 8 with 10% sodium carbonate solution. The water layer was separated, the oily substance was washed twice with an equal volume of 50% ethanol, the washed oily substance was added with sodium carbonate, stirred intermittently, and dried for 24h. Filtration to obtain 1-bromotetradecane.

Suppliers100 total

国药集团化学试剂有限公司86-21-63210123 · [email protected]
梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
衢州润东化工有限公司0570-8789886 18892685668 · [email protected]
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
爱斯特(成都)生物制药股份有限公司+86-28-85122536 85324413 · [email protected]

Related reactions

141 records

Compound notes

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