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3,6,9,12,15,18,21-Heptaoxapentatriacontan-1-ol

HCID 218033
NotesReactions

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Basic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
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Basic information

CAS
40036-79-1
Standard SMILES
CCCCCCCCCCCCCCOCCOCCOCCOCCOCCOCCOCCO
InChIKey
JEKWNQSRRXIGSA-UHFFFAOYSA-N
Molecular formula
C28H58O8
Average molar mass
522.8 g/mol
Monoisotopic mass
522.4131688

Names & identifiers

Preferred name
3,6,9,12,15,18,21-Heptaoxapentatriacontan-1-ol
IUPAC
2-[2-[2-[2-[2-[2-(2-tetradecoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethanol
English name
C14E7
Molecular formula
C28H58O8
Molecular weight
522.76

Names & synonyms

3,6,9,12,15,18,21-heptaoxapentatriacontan-1-olDTXSID40960497RefChem:1066050DTXCID80138835040036-79-1heptaethylene glycol monotetradecyl etherSCHEMBL59914NS00076611C14E7TETRADECYLHEPTAGLYCOLtetradecylheptaethoxylatePOLYOXYETHYLENE 7 MYRISTYL ETHER
Show more names
C14E7, Polyoxyethylene (7) myristyl ether, Tetradecylheptaglycol

Database identifiers

CAS
40036-79-1
PubChem CID
218033
DTXSID
DTXSID40960497
Nikkaji
J646.383E

Properties

Computed structural propertiesFilling in

XLogP
5.3
Topological polar surface area
84.8 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
8
Rotatable bonds
33
Heavy atoms
36
Formal charge
0
Complexity
373

Physicochemical properties

Boiling point
576.6 · 576.6±45.0 °C(Predicted)
Density
0.981 · 0.981±0.06 g/cm3(Predicted)
pka
14.36 · 14.36±0.10(Predicted)
EWG's Food Scores
1 · 1
FDA UNII
65 D9ARX5YY · 65D9ARX5YY
EPA Substance Registry System
3 · 3,6,9,12,15,18,21-Heptaoxapentatriacontan-1-ol (40036-79-1)
Hazard Codes
Xi
Risk Statements
36 · 36/37/38
Safety Statements
26 · 26-36
RTECS
9357500 · XB9357500

Safety & regulation

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

Safety data

rtecs
XB9357500
risk_code
36/37/38
hazard_code
Xi
safety_code
26-36

Chemistry & industry

Suppliers2 total

安那莱(齐河)新材料科技有限公司18600642180(微信同) 13391601435 · [email protected]
BOC Sciences+1-631-485-4226 · [email protected]

Related reactions

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Compound notes

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On this pageBasic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes