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3043-60-5 | Boroxin, 2,4,6-triethyl-
CAS No: 3043-60-5 Catalog No: AG00303K MDL No:MFCD28385679
Product Description
Catalog Number:
AG00303K
Chemical Name:
Boroxin, 2,4,6-triethyl-
CAS Number:
3043-60-5
Molecular Formula:
C6H15B3O3
Molecular Weight:
167.6145
MDL Number:
MFCD28385679
IUPAC Name:
2,4,6-triethyl-1,3,5,2,4,6-trioxatriborinane
InChI:
InChI=1S/C6H15B3O3/c1-4-7-10-8(5-2)12-9(6-3)11-7/h4-6H2,1-3H3
InChI Key:
QVRPRGWIJQKENN-UHFFFAOYSA-N
SMILES:
CCB1OB(CC)OB(O1)CC
Properties
Complexity:
99.4
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
168.13g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
167.613g/mol
Monoisotopic Mass:
168.13g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
27.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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