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89561-36-4 | 1,3,2-Dioxaborinane, 2-(1-methylethyl)-5-(2-methylpropyl)-
CAS No: 89561-36-4 Catalog No: AG003Y9F MDL No:
Product Description
Catalog Number:
AG003Y9F
Chemical Name:
1,3,2-Dioxaborinane, 2-(1-methylethyl)-5-(2-methylpropyl)-
CAS Number:
89561-36-4
Molecular Formula:
C10H21BO2
Molecular Weight:
184.0835
IUPAC Name:
5-(2-methylpropyl)-2-propan-2-yl-1,3,2-dioxaborinane
InChI:
InChI=1S/C10H21BO2/c1-8(2)5-10-6-12-11(9(3)4)13-7-10/h8-10H,5-7H2,1-4H3
InChI Key:
LLMUGBXKDVJEAU-UHFFFAOYSA-N
SMILES:
CC(CC1COB(OC1)C(C)C)C
Properties
Complexity:
140
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
184.163g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
184.086g/mol
Monoisotopic Mass:
184.163g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
18.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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