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2-(Dicyclohexylamino)-ethanol borate

HCID 82043
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Basic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
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Basic information

CAS
7539-58-4
Standard SMILES
C1CCC(N(CCOB(OCCN(C2CCCCC2)C2CCCCC2)OCCN(C2CCCCC2)C2CCCCC2)C2CCCCC2)CC1
InChIKey
CLLRNFFLFVAFFV-UHFFFAOYSA-N
Molecular formula
C42H78BN3O3
Average molar mass
683.9 g/mol
Monoisotopic mass
683.6136235

Names & identifiers

Preferred name
2-(Dicyclohexylamino)-ethanol borate
IUPAC
tris[2-(dicyclohexylamino)ethyl] borate
English name
tris[2-(dicyclohexylamino)ethyl] borate
Molecular formula
C42H78BN3O3
Molecular weight
683.89802

Names & synonyms

tris[2-(dicyclohexylamino)ethyl] borate2-(Dicyclohexylamino)-ethanol borateEINECS 231-414-1Tris(N,N-dicyclohexylaminoethyl)borateUNII-Y624F1P6G1Ethanol, 2-(dicyclohexylamino)-, triester with boric acid (H3BO3)Y624F1P6G1Tris(2-(dicyclohexylamino)ethyl) borateDTXSID7064738Ethanol, 2-(dicyclohexylamino)-, 1,1',1''-triester with boric acid (H3BO3)2-(DICYCLOHEXYLAMINO)ETHANOL BORATEETHANOL, 2-(DICYCLOHEXYLAMINO)-, BORATE
Show more names
Tris[2-(dicyclohexylamino)ethoxy]borane
RefChem:197622DTXCID70477767539-58-4CLLRNFFLFVAFFV-UHFFFAOYSA-NNS00046356Q27294299

Database identifiers

CAS
7539-58-4
PubChem CID
82043
DTXSID
DTXSID7064738
UNII
Y624F1P6G1

Properties

Computed structural properties

Topological polar surface area
37.4 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
6
Rotatable bonds
18
Heavy atoms
49
Formal charge
0
Complexity
683

Physicochemical properties

FDA UNII
624 F1P6G1 · Y624F1P6G1
EPA Substance Registry System
2 · Ethanol, 2-(dicyclohexylamino)-, triester with boric acid (H3BO3) (7539-58-4)
TSCA
TSCA listed

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

tsca
TSCA listed

Chemistry & industry

Uses & manufacturing

General Manufacturing InformationEthanol, 2-(dicyclohexylamino)-, 1,1',1''-triester with boric acid (H3BO3): INACTIVE

Related reactions

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Compound notes

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On this pageBasic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
EC Number
231-414-1
Nikkaji
J307.869H