CAS
94265-97-1 Purity
96%
94265-97-1 Purity
96%
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Tris[3-(dimethylamino)-2,2-dimethylpropyl]orthoborate
CAS
94266-00-9
Catalog Number
ACM94266009
Category
Other Products
Molecular Weight
401.435120 [g/mol]
Molecular Formula
C21H48BN3O3
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Specification
Synonyms
94266-00-9, tris[3-(dimethylamino)-2,2-dimethylpropyl] borate, EINECS 304-406-1, AC1L50NI, CTK5H6144, tris[3- -2,2-dimethylpropyl]orthoborate, Tris(3-(dimethylamino)-2,2-dimethylpropyl) orthoborate
IUPAC Name
tris[3-(dimethylamino)-2,2-dimethylpropyl] borate
Canonical SMILES
B(OCC(C)(C)CN(C)C)(OCC(C)(C)CN(C)C)OCC(C)(C)CN(C)C
InChI Key
ZOMVQCXUYPVEPS-UHFFFAOYSA-N
EC Number
304-406-1
H-Bond Acceptor
6
H-Bond Donor
0
What is the molecular formula of Tris[3-(dimethylamino)-2,2-dimethylpropyl]orthoborate?
The molecular formula is C21H48BN3O3.
What is the molecular weight of Tris[3-(dimethylamino)-2,2-dimethylpropyl]orthoborate?
The molecular weight is 401.4 g/mol.
What is the IUPAC name of Tris[3-(dimethylamino)-2,2-dimethylpropyl]orthoborate?
The IUPAC name is tris[3-(dimethylamino)-2,2-dimethylpropyl]borate.
What is the InChI of Tris[3-(dimethylamino)-2,2-dimethylpropyl]orthoborate?
The InChI is InChI=1S/C21H48BN3O3/c1-19(2,13-23(7)8)16-26-22(27-17-20(3,4)14-24(9)10)28-18-21(5,6)15-25(11)12/h13-18H2,1-12H3.
What is the InChIKey of Tris[3-(dimethylamino)-2,2-dimethylpropyl]orthoborate?
The InChIKey is ZOMVQCXUYPVEPS-UHFFFAOYSA-N.
How many hydrogen bond acceptor counts are in Tris[3-(dimethylamino)-2,2-dimethylpropyl]orthoborate?
There are 6 hydrogen bond acceptor counts.
What is the exact mass of Tris[3-(dimethylamino)-2,2-dimethylpropyl]orthoborate?
The exact mass is 401.3788726 g/mol.
How many rotatable bond counts are in Tris[3-(dimethylamino)-2,2-dimethylpropyl]orthoborate?
There are 15 rotatable bond counts.
Is Tris[3-(dimethylamino)-2,2-dimethylpropyl]orthoborate a canonicalized compound?
Yes, it is a canonicalized compound.
What is the topological polar surface area of Tris[3-(dimethylamino)-2,2-dimethylpropyl]orthoborate?
The topological polar surface area is 37.4 ㎡.
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