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89561-46-6 | 1,3,2-Dioxaborinane, 5-methyl-2-(1-methylethyl)-5-(2-propenyl)-
CAS No: 89561-46-6 Catalog No: AG003Y9D MDL No:
Product Description
Catalog Number:
AG003Y9D
Chemical Name:
1,3,2-Dioxaborinane, 5-methyl-2-(1-methylethyl)-5-(2-propenyl)-
CAS Number:
89561-46-6
Molecular Formula:
C10H19BO2
Molecular Weight:
182.0677
IUPAC Name:
5-methyl-2-propan-2-yl-5-prop-2-enyl-1,3,2-dioxaborinane
InChI:
InChI=1S/C10H19BO2/c1-5-6-10(4)7-12-11(9(2)3)13-8-10/h5,9H,1,6-8H2,2-4H3
InChI Key:
DMLBAYXIWOPAHG-UHFFFAOYSA-N
SMILES:
C=CCC1(C)COB(OC1)C(C)C
Properties
Complexity:
172
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
182.148g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
182.07g/mol
Monoisotopic Mass:
182.148g/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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