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102-24-9 | Boroxin, 2,4,6-trimethoxy-
CAS No: 102-24-9 Catalog No: AG00067U MDL No:MFCD00005946
Product Description
Catalog Number:
AG00067U
Chemical Name:
Boroxin, 2,4,6-trimethoxy-
CAS Number:
102-24-9
Molecular Formula:
C3H9B3O6
Molecular Weight:
173.5330
MDL Number:
MFCD00005946
IUPAC Name:
2,4,6-trimethoxy-1,3,5,2,4,6-trioxatriborinane
InChI:
InChI=1S/C3H9B3O6/c1-7-4-10-5(8-2)12-6(9-3)11-4/h1-3H3
InChI Key:
ZFMOJHVRFMOIGF-UHFFFAOYSA-N
SMILES:
COB1OB(OC)OB(O1)OC
EC Number:
203-016-8
NSC Number:
56370
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:
174.068g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
173.529g/mol
Monoisotopic Mass:
174.068g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
55.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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